SCHEMBL787648

SCHEMBL787648

Cn1cc2cc3nc(-c4c(Cl)cc[nH]c4=O)[nH]c3cc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 4/20 0.43
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ATM Q13315 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
HRH4 Q9H3N8 2/20 0.40
PDGFRB P09619 2/20 0.38
FGFR1 P11362 2/20 0.38
KDR P35968 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.37
IGF1R P08069 3/20 0.37
JAK2 O60674 2/20 0.36
JAK1 P23458 2/20 0.36
TYK2 P29597 2/20 0.36
JAK3 P52333 2/20 0.36
PRKAA1 Q13131 2/20 0.36
NUAK1 O60285 1/20 0.36
PDGFRA P16234 1/20 0.36

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
SCHEMBL438772 0.83 NTRK1 (0.45) RHEBNPC1RAB9AATMERAP1
SCHEMBL5009107 0.80 RHEB (0.44) RHEBNPC1RAB9AATMERAP1
SCHEMBL5009086 0.78 RHEB (0.41) RHEBNPC1RAB9AATMERAP1
SCHEMBL441639 0.78 RHEB (0.45) RHEBNPC1RAB9AATMERAP1
Hydrochloric Acid SCHEMBL5006204 0.77 RHEB (0.40) RHEBNPC1RAB9AATMERAP1
SCHEMBL453373 0.77 NTRK1 (0.44) RHEBNPC1RAB9AATMERAP1
SCHEMBL439680 0.75 NTRK1 (0.61) RHEBNPC1RAB9AATMERAP1
SCHEMBL441645 0.75 RHEB (0.43) RHEBNPC1RAB9AATMERAP1
SCHEMBL438747 0.74 RHEB (0.41) RHEBNPC1RAB9AATMERAP1
SCHEMBL5131647 0.74 PDE3B (0.56) RHEBNPC1RAB9AATMERAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012037155-A2 TYROSINE KINASE INHIBITORS GTX, INC. (US) 2012-03-22 WO disclosed