SCHEMBL1737062

SCHEMBL1737062

COCCn1c(C)c(C)c2ccnc(COc3ccc(C)cc3)c21

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.49
NPC1 O15118 4/20 0.49
TP53 P04637 3/20 0.49
TSHR P16473 3/20 0.49
KMT2A Q03164 3/20 0.49
AR P10275 1/20 0.39
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
EGFR P00533 1/20 0.37
MEN1 O00255 2/20 0.34
QPCT Q16769 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HASPIN Q8TF76 1/20 0.34
NR2F2 P24468 1/20 0.34
NPSR1 Q6W5P4 1/20 0.33

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 SCHEMBL1736429 0.99 RAB9A (0.48) RAB9ANPC1TP53TSHRKMT2A
SCHEMBL1739067 0.92 RAB9A (0.41) RAB9ANPC1TP53TSHRKMT2A
Hydrochloric Acid SCHEMBL1736057 0.91 RAB9A (0.40) RAB9ANPC1TP53TSHRKMT2A
SCHEMBL1737044 0.88 DYRK1A (0.41) RAB9ANPC1TP53TSHRKMT2A
Hydrochloric Acid SCHEMBL1736072 0.87 DYRK1A (0.40) RAB9ANPC1TP53TSHRKMT2A
SCHEMBL1736200 0.85 TSHR (0.36) RAB9ANPC1TP53TSHRKMT2A
SCHEMBL1739295 0.85 RAB9A (0.45) RAB9ANPC1TP53TSHRKMT2A
Hydrochloric Acid SCHEMBL1736557 0.85 KMT2A (0.35) RAB9ANPC1TP53TSHRKMT2A
SCHEMBL1737431 0.84 L3MBTL1 (0.38) RAB9ANPC1TP53TSHRKMT2A
Hydrochloric Acid SCHEMBL1737677 0.84 RAB9A (0.44) RAB9ANPC1TP53TSHRKMT2A

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