SCHEMBL16008307

SCHEMBL16008307

COc1ccc(C(=CC(N)=O)c2ccc(NC(=O)Nc3cc(C(F)(F)F)ccc3F)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 1.00
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
NPC1 O15118 3/20 0.55
RAB9A P51151 3/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
MAPT P10636 1/20 0.55
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
TEK Q02763 9/20 0.53
FLT1 P17948 1/20 0.53
PDGFRB P09619 1/20 0.52
PKM P14618 1/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
RAF1 P04049 1/20 0.49

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
SCHEMBL16008305 1.00 KDR (1.00) KDRMEN1KMT2ANPC1RAB9A
SCHEMBL16008043 0.92 KDR (1.00) KDRMEN1KMT2ANPC1RAB9A
SCHEMBL16008046 0.92 KDR (1.00) KDRMEN1KMT2ANPC1RAB9A
SCHEMBL16008185 0.88 KDR (1.00) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL16008183 0.88 KDR (1.00) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL16008186 0.88 KDR (1.00) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL16008163 0.80 KDR (0.85) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL16008166 0.80 KDR (0.85) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL16008165 0.80 KDR (0.85) KDRMEN1KMT2ARAB9AMAPT
SCHEMBL31504006 0.79 KDR (0.66) KDRNPC1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9321721-B2 Kinase inhibitors ALLERGAN, INC. (US) 2016-04-26 US claimed
WO-2014138452-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2014-09-12 WO claimed
US-20140256819-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2014-09-11 US claimed
US-9321721-B2 Kinase inhibitors ALLERGAN, INC. (US) 2016-04-26 US disclosed
WO-2014138452-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2014-09-12 WO disclosed
US-20140256819-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2014-09-11 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-20140256819-A1 KINASE INHIBITORS CDK1, MAP3K1, MAPK1 KDR 322/4885MEN1 1158/4885KMT2A 2223/4885

“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.