SCHEMBL20022397

SCHEMBL20022397

Cc1cc2nccc(Oc3ccc([N+](=O)[O-])cc3F)c2cc1C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 4/20 0.47
S1PR4 O95977 1/20 0.46
PDGFRA P16234 3/20 0.44
KDR P35968 3/20 0.44
SRC P12931 1/20 0.41
TGFBR1 P36897 1/20 0.41
FGFR2 P21802 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MET P08581 6/20 0.40
AXL P30530 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
IGF1R P08069 1/20 0.39

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
SCHEMBL20032552 0.91 PDGFRA (0.51) HSPB1S1PR4PDGFRAKDRSRC
SCHEMBL174159 0.87 PDGFRA (0.59) PDGFRAKDRSRCTGFBR1FGFR2
SCHEMBL29487188 0.87 PDGFRA (0.59) PDGFRAKDRSRCTGFBR1FGFR2
SCHEMBL21201082 0.86 MET (0.51) PDGFRAKDRSRCTGFBR1MET
SCHEMBL30616294 0.86 MET (0.51) PDGFRAKDRSRCTGFBR1MET
SCHEMBL16089916 0.86 PDGFRA (0.44) PDGFRAKDRSRCTGFBR1ALDH1A1
SCHEMBL27886827 0.83 HSPB1 (0.47) HSPB1S1PR4PDGFRAKDRFGFR2
SCHEMBL13936618 0.83 PDGFRA (0.52) PDGFRAKDRSRCTGFBR1FGFR2
SCHEMBL30697769 0.83 PDGFRA (0.52) PDGFRAKDRSRCTGFBR1FGFR2
SCHEMBL22960033 0.83 KDR (0.50) PDGFRAKDRFGFR2METAXL

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
US-20180093968-A1 QUINOLINE DERIVATIVES AS TAM RTK INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2018-04-05 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-20180093968-A1 QUINOLINE DERIVATIVES AS TAM RTK INHIBITORS TYRO3, MERTK, AXL HSPB1 2587/4885S1PR4 2876/4885PDGFRA 111/4885

“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.