SCHEMBL2836170

SCHEMBL2836170

[c]1cc(-c2ccc(-c3ccccc3)cc2)no1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 1/20 0.41
BCL2L1 Q07817 1/20 0.41
RAB9A P51151 7/20 0.41
NPC1 O15118 5/20 0.41
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 5/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
NTSR1 P30989 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
GABRA1 P14867 1/20 0.36

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
SCHEMBL211482 0.98 RAB9A (0.42) MMP3BCL2L1RAB9ANPC1MEN1
SCHEMBL346163 0.78 NOTUM (0.42) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL4322903 0.78 ENPP3 (0.42) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL4308652 0.78 RAB9A (0.40) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL1154499 0.78 MAPT (0.42) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL2407790 0.76 CYP1A2 (0.51) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL973674 0.76 CYP2A6 (0.50) RAB9ANPC1SMN1; SMN2ALDH1A1KDM4E
SCHEMBL2590942 0.76 RAB9A (0.54) RAB9ANPC1MEN1KMT2ASMN1; SMN2
SCHEMBL9269460 0.75 ESR2 (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL1897908 0.75 NOTUM (0.47) RAB9ANPC1SMN1; SMN2MAPTNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2251324-A1 HETEROARYL-ALKYLCARBAMATE COMPOUNDS AND THEIR USE AS INHIBITORS OF THE FAAH ENZYME Sanofi-Aventis (FR) 2010-11-17 EP disclosed
EP-1720829-B1 DERIVATIVES OF HETEROARYL-ALKYLCARBAMATES, PREPARATION METHOD THEREOF AND USE OF SAME AS FAAH ENZYME INHIBITORS SANOFI AVENTIS (FR) 2009-10-14 EP disclosed