SCHEMBL17010387

SCHEMBL17010387

COc1ccc(C2=NOC(C(=O)N3CCCCC3)C2)cc1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.78
MIF P14174 2/20 0.69
NPC1 O15118 2/20 0.64
RAB9A P51151 2/20 0.64
SMN1; SMN2 Q16637 2/20 0.64
CASP1 P29466 1/20 0.64
ALDH1A1 P00352 2/20 0.64
TSHR P16473 1/20 0.63
PDE4A P27815 4/20 0.62
PDE4B Q07343 4/20 0.62
PDE4C Q08493 4/20 0.62
PDE4D Q08499 4/20 0.62
MAPT P10636 3/20 0.61
KDM4E B2RXH2 2/20 0.61
GAA P10253 1/20 0.61
HSD17B10 Q99714 1/20 0.61
MAPK1 P28482 2/20 0.58
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
CREBBP Q92793 1/20 0.57

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
SCHEMBL18279371 0.99 USP2 (0.76) USP2MIFNPC1RAB9ASMN1; SMN2
SCHEMBL17003822 0.91 PDE4A (0.78) USP2MIFNPC1RAB9ASMN1; SMN2
SCHEMBL17010357 0.90 TSHR (0.78) USP2MIFNPC1RAB9ASMN1; SMN2
SCHEMBL17003763 0.90 PDE4A (0.77) USP2MIFNPC1RAB9ASMN1; SMN2
SCHEMBL17003843 0.83 PDE4B (0.73) USP2MIFNPC1RAB9AALDH1A1
SCHEMBL17003880 0.83 PDE4D (0.73) USP2MIFNPC1RAB9AALDH1A1
SCHEMBL7399375 0.81 MIF (1.00) MIFSMN1; SMN2ALDH1A1PDE4APDE4B
SCHEMBL17003858 0.78 PDE4D (0.72) USP2MIFALDH1A1TSHRPDE4A
SCHEMBL18288878 0.77 PDE4A (0.56) USP2NPC1RAB9ASMN1; SMN2CASP1
SCHEMBL18288875 0.76 PDE4A (0.56) USP2NPC1RAB9ASMN1; SMN2CASP1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3105206-B1 MORPHOLINE DERIVATIVES HAVING A SELECTIVE PDE4D INHIBITING ACTIVITY UNIV DEGLI STUDI GENOVA (IT) 2019-08-07 EP disclosed
US-10017480-B2 Compounds having a selective PDE4D inhibiting activity UNIVERSITA DEGLI STUDI DI GENOVA (IT) 2018-07-10 US disclosed
EP-3105206-A1 NEW COMPOUNDS HAVING A SELECTIVE PDE4D INHIBITING ACTIVITY Universita' degli Studi di Genova (IT) 2016-12-21 EP disclosed
US-20160355489-A1 NEW COMPOUNDS HAVING A SELECTIVE PDE4D INHIBITING ACTIVITY THE TRUSTEES OF COLUMBIA UNIVERSITY 2016-12-08 US disclosed
WO-2015121212-A1 NEW COMPOUNDS HAVING A SELECTIVE PDE4D INHIBITING ACTIVITY UNIVERSITÀ DEGLI STUDI DI GENOVA (IT) 2015-08-20 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 (2 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-20160355489-A1 NEW COMPOUNDS HAVING A SELECTIVE PDE4D INHIBITING ACTIVITY PDE4A, PDE4D, PDE4B USP2 963/4885MIF 4228/4885NPC1 1531/4885
US-10017480-B2 Compounds having a selective PDE4D inhibiting activity PDE4A, PDE4D, PDE2A USP2 1110/4885MIF 4248/4885NPC1 1620/4885

“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.