SCHEMBL1622571

SCHEMBL1622571

COc1ccc(-c2nc(N3CCOCC3)c3sc(Nc4ncc(C(=O)NO)cn4)cc3n2)cn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.71
PIK3CA P42336 11/20 0.71
PIK3CD O00329 7/20 0.71
HDAC2 Q92769 6/20 0.71
PIK3CB P42338 6/20 0.71
PIK3CG P48736 6/20 0.71
MTOR P42345 6/20 0.71
HDAC10 Q969S8 5/20 0.71
HDAC11 Q96DB2 5/20 0.71
HDAC6 Q9UBN7 5/20 0.71
HDAC3 O15379 5/20 0.71
PIK3R1 P27986 4/20 0.71
HDAC4 P56524 3/20 0.71
HDAC7 Q8WUI4 3/20 0.71
HDAC8 Q9BY41 3/20 0.71
HDAC9 Q9UKV0 3/20 0.71
HDAC5 Q9UQL6 3/20 0.71
NCOR2 Q9Y618 3/20 0.71
PRKDC P78527 1/20 0.71
KCNH2 Q12809 1/20 0.71

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1620625 0.88 HDAC1 (0.71) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
SCHEMBL1284862 0.86 PIK3CA (0.70) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
SCHEMBL30130754 0.86 HDAC1 (0.68) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
SCHEMBL1622219 0.86 HDAC1 (0.68) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
SCHEMBL1623616 0.86 HDAC1 (0.54) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
Fimepinostat SCHEMBL29353052 0.83 HDAC1 (1.00) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
Fimepinostat SCHEMBL1284705 0.83 HDAC1 (1.00) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
Fimepinostat SCHEMBL29493089 0.83 HDAC1 (1.00) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
Fimepinostat SCHEMBL12813051 0.83 HDAC1 (0.99) HDAC1PIK3CAPIK3CDHDAC2PIK3CB
Fimepinostat SCHEMBL12813120 0.83 HDAC1 (0.99) HDAC1PIK3CAPIK3CDHDAC2PIK3CB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227467-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2023-07-20 US disclosed
US-20230227467-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2023-07-20 US disclosed
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2022-12-22 US disclosed
US-20210214370-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2021-07-15 US disclosed
US-10894795-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2021-01-19 US disclosed
US-20200339593-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2020-10-29 US disclosed
US-10676482-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2020-06-09 US disclosed
US-20190352310-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2019-11-21 US disclosed
US-10336770-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2019-07-02 US disclosed
US-20170362251-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2017-12-21 US disclosed
US-8906909-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2014-12-09 US disclosed
US-20140155595-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS, INC. (US) 2014-06-05 US disclosed
US-20140155595-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS, INC. (US) 2014-06-05 US disclosed
US-8461157-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2013-06-11 US disclosed
US-8461157-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety CURIS, INC. (US) 2013-06-11 US disclosed
US-20130102595-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS CURIS, INC. 2013-04-25 US disclosed
US-20130102595-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS CURIS, INC. 2013-04-25 US disclosed
US-20120088764-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS, INC. 2012-04-12 US disclosed
US-20120088764-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS, INC. 2012-04-12 US disclosed
WO-2011130628-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS CURIS, INC. (US) 2011-10-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140155595-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-10336770-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-20210214370-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 58/4885PIK3CD 39/4885
US-20170362251-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-10894795-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 58/4885PIK3CD 39/4885
US-20120088764-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-20200339593-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 58/4885PIK3CD 39/4885
US-20230227467-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-10676482-B2 Phosphoinositide 3-kinase inhibitors with a zinc binding moiety BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885
US-20130102595-A1 TREATMENT OF CANCERS HAVING K-RAS MUTATIONS KRAS, HRAS, KSR2 HDAC1 6/4885PIK3CA 31/4885PIK3CD 194/4885
US-20190352310-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB HDAC1 10/4885PIK3CA 57/4885PIK3CD 37/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.