SCHEMBL156167

SCHEMBL156167

COc1cc2ncnc(Nc3ccc4ccccc4c3)c2cc1N

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.69
RET P07949 7/20 0.62
KDR P35968 7/20 0.62
CLK1 P49759 1/20 0.60
ABCG2 Q9UNQ0 1/20 0.60
RIPK2 O43353 1/20 0.60
EPHB2 P29323 1/20 0.60
LCK P06239 4/20 0.59
SRC P12931 1/20 0.59
KIF5B P33176 1/20 0.56
FLT1 P17948 1/20 0.55

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
SCHEMBL6181200 0.90 EGFR (0.74) EGFRRETKDRCLK1ABCG2
Hydrochloric Acid SCHEMBL6180787 0.89 EGFR (0.74) EGFRRETKDRCLK1ABCG2
SCHEMBL160997 0.88 EGFR (0.68) EGFRRETKDRCLK1ABCG2
SCHEMBL19885303 0.87 EGFR (0.80) EGFRRETKDRRIPK2EPHB2
SCHEMBL15390777 0.85 EGFR (0.83) EGFRRETKDRRIPK2EPHB2
SCHEMBL2946975 0.84 EGFR (0.71) EGFRRETKDRCLK1ABCG2
SCHEMBL1418218 0.82 EGFR (0.82) EGFRRETKDRABCG2EPHB2
SCHEMBL15050338 0.81 EGFR (0.71) EGFRRETKDRCLK1ABCG2
SCHEMBL1417950 0.81 EGFR (0.82) EGFRRETKDREPHB2LCK
SCHEMBL2974730 0.81 EGFR (1.00) EGFRRETKDRABCG2EPHB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2611797-B1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO LTD (KR) 2016-12-28 EP disclosed
US-8835458-B2 Quinoline or quinazoline derivatives with apoptosis inducing activity on cells HANMI SCIENCE CO., LTD (KR) 2014-09-16 US disclosed
EP-2611797-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS Hanmi Science Co., Ltd. (KR) 2013-07-10 EP disclosed
US-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI SCIENCE CO., LTD (KR) 2013-06-27 US disclosed
WO-2012030160-A2 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS HANMI HOLDINGS CO., LTD. (KR) 2012-03-08 WO 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-20130165386-A1 QUINOLINE OR QUINAZOLINE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS CASP7, API5, BAX EGFR 4690/4885RET 4064/4885KDR 4712/4885

“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.