SCHEMBL1035526

SCHEMBL1035526

Cc1cccc(/C=C2\CCN(C(=O)Nc3nnc(-c4ccccc4)o3)CC2C)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.48
RAB9A P51151 3/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 3/20 0.41
ALDH1A1 P00352 3/20 0.41
GFER P55789 1/20 0.41
L3MBTL1 Q9Y468 4/20 0.41
HTT P42858 3/20 0.41
TP53 P04637 2/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
OPRK1 P41145 1/20 0.41
CCR6 P51684 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
HSD17B10 Q99714 1/20 0.39
PTGS2 P35354 1/20 0.39
GPR65 Q8IYL9 1/20 0.38
TSHR P16473 3/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL1035528 1.00 KDM4E (0.48) KDM4ERAB9AKMT2ALMNAALDH1A1
SCHEMBL1033321 0.91 USP30 (0.43) KDM4EKMT2ALMNAALDH1A1L3MBTL1
SCHEMBL1033319 0.91 USP30 (0.43) KDM4EKMT2ALMNAALDH1A1L3MBTL1
SCHEMBL1033109 0.91 KDM4E (0.43) KDM4EALDH1A1L3MBTL1HTTHSD17B10
SCHEMBL1033111 0.91 KDM4E (0.43) KDM4EALDH1A1L3MBTL1HTTHSD17B10
SCHEMBL1032431 0.89 KDM4E (0.41) KDM4ERAB9AKMT2ALMNAALDH1A1
SCHEMBL1034745 0.89 KDM4E (0.39) KDM4ERAB9AKMT2AALDH1A1L3MBTL1
SCHEMBL1082986 0.89 KDM4E (0.39) KDM4ELMNAALDH1A1L3MBTL1HTT
SCHEMBL1035238 0.89 KDM4E (0.40) KDM4ERAB9AKMT2ALMNAALDH1A1
SCHEMBL1082984 0.89 KDM4E (0.39) KDM4ELMNAALDH1A1L3MBTL1HTT

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
US-20110053950-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER, INC. 2011-03-03 US claimed
EP-2276734-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP claimed
WO-2009127946-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 WO claimed
EP-2276734-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS Pfizer Inc. (US) 2011-01-26 EP disclosed
WO-2009127946-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS PFIZER INC. (US) 2009-10-22 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 (1 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-20110053950-A1 4-BENZYLIDENE-3-METHYLPIPERIDINE ARYL CARBOXAMIDE COMPOUNDS USEFUL AS FAAH INHIBITORS FAAH, FAAH2, CNR2 KDM4E 626/4885RAB9A 1238/4885KMT2A 601/4885

“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.