SCHEMBL8784378

SCHEMBL8784378

Cc1ccccc1CCn1nnc(-c2ccccc2-c2ccc(C=O)cc2)n1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.39
RAB9A P51151 2/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALOX5 P09917 1/20 0.38
ATM Q13315 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
PKM P14618 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL8783166 0.74 ABCG2 (0.39) ALDH1A1ATMABCG2MEN1KMT2A
SCHEMBL8783160 0.73 ABCG2 (0.36) LMNAPOLBRAB9ATSHRALDH1A1
SCHEMBL7352477 0.72 ABCG2 (0.41) POLBSMN1; SMN2RAB9ATSHRALDH1A1
SCHEMBL21774158 0.69 LMNA (0.47) LMNASMN1; SMN2TSHRL3MBTL1MAPT
SCHEMBL7352872 0.68 ABCG2 (0.41) POLBSMN1; SMN2RAB9AALDH1A1NPC1
SCHEMBL8783164 0.68 TDP1 (0.39) ALOX5ABCG2MEN1KMT2A
SCHEMBL29438438 0.68 CA12 (0.52) TSHRALDH1A1
SCHEMBL1313610 0.68 CA12 (0.52) TSHRALDH1A1
SCHEMBL4638150 0.68 AGTR1 (0.45) POLBSMN1; SMN2RAB9AALDH1A1NPC1
SCHEMBL7772856 0.68 MAOB (0.43) LMNASMN1; SMN2RAB9AL3MBTL1ATM

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-0760814-A1 A PROCESS FOR PREPARING 1-BUTYL-2-[2'-(2H-TETRAZOL-5-YL)-BIPHENYL-4-YLMETHYL]-1H-INDOLE-3-CARBOXYLIC ACID SYNTEX (U.S.A.) INC. (US) 1997-03-12 EP disclosed
WO-1995032961-A1 A PROCESS FOR PREPARING 1-BUTYL-2-[2'-(2H-TETRAZOL-5-YL)-BIPHENYL-4-YLMETHYL]-1H-INDOLE-3-CARBOXYLIC ACID SYNTEX (U.S.A.) INC. (US) 1995-12-07 WO disclosed