SCHEMBL1737369

SCHEMBL1737369

CCCn1c(C)c(C)c2ccnc(CNc3ccc(F)cc3)c21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.37
MAPT P10636 4/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
ALOX12 P18054 1/20 0.36
MPI P34949 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
ALPG P10696 1/20 0.34
HTT P42858 1/20 0.34
MAPK14 Q16539 3/20 0.34
AURKA O14965 1/20 0.34
ABL1 P00519 1/20 0.34
NTRK1 P04629 1/20 0.34

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 SCHEMBL1736130 0.99 RAB9A (0.37) RAB9AKMT2ANPC1MAPTALDH1A1
SCHEMBL1735325 0.91 GAA (0.38) RAB9AKMT2ANPC1MAPTALDH1A1
Hydrochloric Acid SCHEMBL1737751 0.89 GAA (0.38) RAB9AKMT2ANPC1MAPTALDH1A1
SCHEMBL1738007 0.88 MAPT (0.36) RAB9AKMT2ANPC1MAPTALDH1A1
SCHEMBL1738965 0.88 MAPT (0.37) RAB9AKMT2ANPC1MAPTALDH1A1
Hydrochloric Acid SCHEMBL1736327 0.87 MAPT (0.35) RAB9AKMT2ANPC1MAPTALDH1A1
Hydrochloric Acid SCHEMBL1735331 0.87 MAPT (0.36) RAB9AKMT2ANPC1MAPTALDH1A1
SCHEMBL1738347 0.85 RAB9A (0.40) RAB9AKMT2ANPC1MAPTALDH1A1
Hydrochloric Acid SCHEMBL1737585 0.84 RAB9A (0.39) RAB9AKMT2ANPC1MAPTALDH1A1
SCHEMBL1735560 0.84 KMT2A (0.37) RAB9AKMT2ANPC1MAPTALDH1A1

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