SCHEMBL3535935

SCHEMBL3535935

COc1cc2c(Oc3ccc(NC(=O)c4cccn(-c5ccc(F)cc5)c4=O)cc3F)ccnc2cc1O

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.71
RIPK3 Q9Y572 3/20 0.69
RIPK1 Q13546 2/20 0.69
LCK P06239 1/20 0.69
KIT P10721 1/20 0.69
KDR P35968 1/20 0.69
FLT3 P36888 1/20 0.69
AXL P30530 6/20 0.69
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
TYRO3 Q06418 1/20 0.64
MERTK Q12866 1/20 0.64
RIPK2 O43353 1/20 0.64

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
SCHEMBL2479034 0.95 MET (0.79) METRIPK3RIPK1LCKKIT
SCHEMBL13349061 0.91 MET (0.69) METRIPK3RIPK1LCKKIT
SCHEMBL13314728 0.89 MET (0.69) METRIPK3RIPK1LCKKIT
SCHEMBL3539556 0.88 MET (0.74) METRIPK3RIPK1LCKKIT
SCHEMBL14565177 0.87 MET (0.68) METRIPK3RIPK1LCKKIT
SCHEMBL2476315 0.85 MET (0.70) METRIPK3LCKKITKDR
Trifluoroacetic Acid SCHEMBL3541795 0.85 MET (0.71) METRIPK3RIPK1LCKKIT
SCHEMBL13349103 0.85 MET (0.65) METRIPK3RIPK1LCKKIT
SCHEMBL23147358 0.85 MET (0.67) METRIPK3RIPK1LCKKIT
SCHEMBL23147191 0.85 MET (0.66) METRIPK3RIPK1LCKKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732613-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-08 US claimed
WO-2007033196-A1 MET KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 WO claimed
US-20070060613-A1 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-03-15 US claimed
US-7732613-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-08 US disclosed
US-7732613-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-08 US disclosed
US-7732613-B2 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-06-08 US disclosed
WO-2007033196-A1 MET KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 WO disclosed
WO-2007033196-A1 MET KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-03-22 WO disclosed
US-20070060613-A1 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-03-15 US disclosed
US-20070060613-A1 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-03-15 US disclosed
US-20070060613-A1 Met kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2007-03-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070060613-A1 Met kinase inhibitors MET, ERBB2, ABL1 MET 1/4885RIPK3 1057/4885RIPK1 1042/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.