SCHEMBL1737460

SCHEMBL1737460

CCc1c(C)c2ccnc(N3CCc4ccccc4C3)c2n1Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
TSHR P16473 4/20 0.49
PKM P14618 3/20 0.49
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 3/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
GRIN2D O15399 7/20 0.39
GRIN3B O60391 7/20 0.39
GRIN1 Q05586 7/20 0.39
GRIN2A Q12879 7/20 0.39
GRIN2B Q13224 7/20 0.39
GRIN2C Q14957 7/20 0.39
GRIN3A Q8TCU5 7/20 0.39
HPGD P15428 2/20 0.38
LMNA P02545 1/20 0.38
GLA P06280 1/20 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
Hydrochloric Acid SCHEMBL1738175 0.99 ALDH1A1 (0.48) ALDH1A1TSHRPKMMAPTSMN1; SMN2
SCHEMBL1737264 0.89 ALDH1A1 (0.48) ALDH1A1TSHRPKMMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL1735519 0.89 ALDH1A1 (0.48) ALDH1A1TSHRPKMMAPTSMN1; SMN2
SCHEMBL1736608 0.87 HSD17B10 (0.41) ALDH1A1TSHRPKMMAPTSMN1; SMN2
SCHEMBL1737479 0.86 ALDH1A1 (0.48) ALDH1A1TSHRPKMMAPTSMN1; SMN2
SCHEMBL1738953 0.86 GRIN2D (0.45) ALDH1A1TSHRPKMMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL1737901 0.86 HSD17B10 (0.41) ALDH1A1TSHRPKMMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL1738427 0.85 ALDH1A1 (0.48) ALDH1A1TSHRPKMMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL1736915 0.85 GRIN2D (0.44) ALDH1A1TSHRPKMMAPTSMN1; SMN2
SCHEMBL1739551 0.85 GRIN2D (0.45) ALDH1A1TSHRPKMMAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784404-B1 PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2011-11-16 EP claimed
US-20110263306-A1 COMPUTER SYSTEM AND PROGRAM NAMCO BANDAI GAMES INC. (JP) 2011-10-27 US claimed