SCHEMBL868147

SCHEMBL868147

O=CCNC(=O)Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
GAA P10253 2/20 0.56
HPGD P15428 2/20 0.56
ALDH1A1 P00352 5/20 0.54
ATM Q13315 1/20 0.54
LMNA P02545 1/20 0.54
RAB9A P51151 1/20 0.53
CNR1 P21554 1/20 0.53
MAPT P10636 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TRPV1 Q8NER1 1/20 0.53
KCNH2 Q12809 1/20 0.51
ERCC1 P07992 1/20 0.50
ERCC4 Q92889 1/20 0.50
POLB P06746 1/20 0.50
HDAC3 O15379 1/20 0.49

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
SCHEMBL6631803 0.83 KCNH2 (0.58) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL27516888 0.82 MEP1B (0.51) KMT2ARAB9ANPC1
SCHEMBL11279082 0.81 HPGD (0.62) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL868395 0.81 MAPT (0.61) MEN1KMT2AHDAC8HDAC6HPGD
SCHEMBL23959500 0.80 EPHX2 (0.58) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL11034177 0.79 HDAC8 (0.65) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL320807 0.78 HPGD (0.68) EPHX2MEN1KMT2AHDAC8HDAC6
SCHEMBL11111266 0.78 GAA (0.62) MEN1KMT2AHDAC8HDAC6GAA
SCHEMBL392625 0.78 ALDH1A1 (0.82) MEN1KMT2AHDAC8HDAC6GAA
SCHEMBL1454495 0.78 MEN1 (0.63) EPHX2MEN1KMT2AHDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11602527-B2 Methods of use of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2023-03-14 US disclosed
US-20210275508-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS INFINITY PHARMACEUTICALS, INC. 2021-09-09 US disclosed
US-11007181-B2 Cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2021-05-18 US disclosed
US-10821102-B2 Methods of use of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2020-11-03 US disclosed
US-20200121658-A1 CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2020-04-23 US disclosed
US-10406139-B2 Cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2019-09-10 US disclosed
US-10314827-B2 Methods of use of cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2019-06-11 US disclosed
US-20190000816-A1 CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2019-01-03 US disclosed
US-20180338962-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2018-11-29 US disclosed
US-9951083-B2 Cyclopamine analogs INFINITY PHARMACEUTICALS, INC. (US) 2018-04-24 US disclosed
US-20100286180-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS INFINITY PHARMACEUTICALS, INC. (US) 2010-11-11 US disclosed
US-7812164-B2 steroidal alkaloids; for treatment of disorders mediated by hedgehog pathway such as cancer INFINITY PHARMACEUTICALS, INC. (US) 2010-10-12 US disclosed
EP-2101580-A2 METHODS OF USE FOR CYCLOPAMINE ANALOGS Infinity Discovery, Inc. (US) 2009-09-23 EP disclosed
EP-2096917-A2 CYCLOPAMINE ANALOGS Infinity Discovery, Inc. (US) 2009-09-09 EP disclosed
US-20090216022-A1 CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2009-08-27 US disclosed
US-20090012109-A1 CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2009-01-08 US disclosed
US-20080293754-A1 CYCLOPAMINE ANALOGS ROYALTY SECURITY, LLC 2008-11-27 US disclosed
WO-2008083252-A2 METHODS OF USE FOR CYCLOPAMINE ANALOGS INFINITY DISCOVERY, INC. (US) 2008-07-10 WO disclosed
WO-2008083248-A2 CYCLOPAMINE ANALOGS INFINITY DISCOVERY, INC. (US) 2008-07-10 WO disclosed
WO-2008033460-A2 TREATING PAIN, DIABETES, AND LIPID METABOLISM DISORDERS SCHERING CORPORATION (US) 2008-03-20 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 (13 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-10821102-B2 Methods of use of cyclopamine analogs PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885
US-11007181-B2 Cyclopamine analogs PDE6C, GLI1, SHH EPHX2 640/4885MEN1 1685/4885KMT2A 4039/4885
US-20190000816-A1 CYCLOPAMINE ANALOGS PDE6C, GLI1, SHH EPHX2 640/4885MEN1 1685/4885KMT2A 4039/4885
US-10406139-B2 Cyclopamine analogs PDE6C, GLI1, SHH EPHX2 640/4885MEN1 1685/4885KMT2A 4039/4885
US-20090012109-A1 CYCLOPAMINE ANALOGS GLI1, PDE6C, SHH EPHX2 695/4885MEN1 2155/4885KMT2A 3766/4885
US-20090216022-A1 CYCLOPAMINE ANALOGS GLI1, PDE6C, SHH EPHX2 695/4885MEN1 2155/4885KMT2A 3766/4885
US-20210275508-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885
US-20200121658-A1 CYCLOPAMINE ANALOGS PDE6C, GLI1, SHH EPHX2 640/4885MEN1 1685/4885KMT2A 4039/4885
US-11602527-B2 Methods of use of cyclopamine analogs PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885
US-20180338962-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885
US-20100286180-A1 METHODS OF USE OF CYCLOPAMINE ANALOGS PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885
US-20080293754-A1 CYCLOPAMINE ANALOGS GLI1, PDE6C, SHH EPHX2 695/4885MEN1 2155/4885KMT2A 3766/4885
US-10314827-B2 Methods of use of cyclopamine analogs PDE6C, CRYAB, TUBB3 EPHX2 148/4885MEN1 2245/4885KMT2A 3923/4885

“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.