SCHEMBL14469476

SCHEMBL14469476

C=C/C=C(\C=C/N)CN1CCC(C(=O)N2CCN(Cc3cccc(Oc4ccc(C)cc4)c3)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.50
▸ KDM4E B2RXH2 4/20 0.49
▸ CCR8 P51685 3/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ LMNA P02545 3/20 0.47
▸ HTT P42858 1/20 0.47
▸ DRD2 P14416 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL14469462 0.92 FAAH (0.50) FAAHKDM4EPOLBALDH1A1LMNA
SCHEMBL14469470 0.92 FAAH (0.52) FAAHKDM4ECCR8POLBALDH1A1
SCHEMBL14469456 0.88 SMN1; SMN2 (0.50) FAAHKDM4EPOLBALDH1A1HTT
SCHEMBL14469472 0.88 FAAH (0.51) FAAHKDM4ECCR8POLBALDH1A1
SCHEMBL14469463 0.85 KDM4E (0.48) KDM4EPOLBALDH1A1LMNAHTT
SCHEMBL14469553 0.85 KDM4E (0.61) FAAHKDM4EPOLBALDH1A1LMNA
SCHEMBL14469464 0.84 MEN1 (0.45) KDM4EPOLBALDH1A1LMNAHTT
SCHEMBL14469179 0.83 ADRB2 (0.54) FAAHKDM4EPOLBALDH1A1HTT
SCHEMBL14469115 0.83 MEN1 (0.49) FAAHKDM4EPOLBALDH1A1HTT
SCHEMBL14469477 0.83 KMT2A (0.58) KDM4EPOLBALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007075555-A2 COMBINATION OF AN H3 ANTAGONIST/INVERSE AGONIST AND AN APPETITE SUPPRESSANT SCHERING CORPORATION (US) 2007-07-05 — — WO disclosed
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