SCHEMBL7577962

SCHEMBL7577962

Clc1ccc(Cl)c(-c2ccnc3ccccc23)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 6/20 0.50
MAPK14 Q16539 4/20 0.50
FADS1 O60427 1/20 0.47
NR4A2 P43354 1/20 0.45
CYP1A2 P05177 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPK1 P28482 2/20 0.44
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
CYP2C19 P33261 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
GRM4 Q14833 3/20 0.43
NPC1 O15118 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
SCHEMBL28656526 0.82 MAPT (0.53) TGFBR1MAPK14CYP1A2MEN1MAPT
SCHEMBL10436783 0.81 HTR2C (0.54) MEN1KMT2ANPC1RAB9A
SCHEMBL10436792 0.80 HTR2C (0.53) MEN1MAPTKMT2AKDM4ENPC1
SCHEMBL27917128 0.80 CYP1A2 (0.60) TGFBR1MAPK14CYP1A2MAPTALDH1A1
SCHEMBL29699887 0.80 CYP1A2 (0.60) TGFBR1MAPK14CYP1A2MAPTALDH1A1
SCHEMBL1227713 0.80 CYP1A2 (0.60) TGFBR1MAPK14CYP1A2MAPTALDH1A1
SCHEMBL10436636 0.78 HTR2C (0.49) MEN1MAPTKMT2AL3MBTL1ALDH1A1
SCHEMBL30487734 0.78 CYP1A2 (0.58) TGFBR1MAPK14CYP1A2MAPTALDH1A1
SCHEMBL28104399 0.77 ACVR1 (0.50) TGFBR1MAPK14CYP1A2ALDH1A1HPGD
SCHEMBL10436769 0.77 HTR2C (0.56) MEN1MAPTKMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0773248-B1 Polymers with heterocyclic side groups MISSISSIPPI POLYMER TECHNOLOGI (US) 2002-10-02 EP disclosed
US-5668245-A PHENYLENE POLYMERS WITH HETEROCYCLIC SIDE GROUPS MAXDEM INCORPORATED (US) 1997-09-16 US disclosed
EP-0773248-A1 Polymers with heterocyclic side groups MAXDEM INCORPORATED (US) 1997-05-14 EP disclosed