SCHEMBL17047489

SCHEMBL17047489

C=Cc1ccc(-c2cc(CC#N)ccc2Nc2ncc3ccccc3n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PIK3CG P48736 3/20 0.42
▸ PIK3CA P42336 2/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ TNF P01375 1/20 0.35
▸ ACP1 P24666 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33
▸ MAP3K5 Q99683 1/20 0.33
▸ FGFR1 P11362 1/20 0.32
▸ FGFR2 P21802 1/20 0.32
▸ FGFR4 P22455 1/20 0.32
▸ FGFR3 P22607 1/20 0.32
▸ PTK2 Q05397 1/20 0.31
▸ PAK1 Q13153 7/20 0.31
▸ CDK1 P06493 1/20 0.31
▸ KDR P35968 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ MAP4K1 Q92918 1/20 0.30

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
SCHEMBL17047556 0.89 KDR (0.38) PIK3CGPIK3CAPIK3CDTNFACP1
SCHEMBL17047546 0.83 ACP1 (0.39) PIK3CGPIK3CAPIK3CDTNFACP1
SCHEMBL17047552 0.83 PIK3CA (0.44) PIK3CGPIK3CAPIK3CDTNFACP1
SCHEMBL17047468 0.81 PIK3CA (0.43) PIK3CGPIK3CAPIK3CDTNFACP1
SCHEMBL17047465 0.81 MAP3K5 (0.38) PIK3CGPIK3CAPIK3CDACP1MAP3K5
SCHEMBL17047434 0.80 MAP3K5 (0.36) PIK3CGPIK3CAPIK3CDACP1ROCK1
SCHEMBL17047530 0.78 CDK1 (0.39) PIK3CGPIK3CAPIK3CDACP1ROCK1
SCHEMBL17047442 0.77 CYP1A2 (0.50) PIK3CGPIK3CAMEN1MAPTKMT2A
SCHEMBL17047471 0.77 KDM4E (0.39) PIK3CGPIK3CAPIK3CDMAP3K5PAK1
SCHEMBL17047445 0.76 MAP3K5 (0.58) MAP3K5FGFR1PTK2KDRMEN1

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
US-10202374-B2 6-aryl-4-phenylamino-quinazoline analogs as phosphoinositide-3-kinase inhibitors COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2019-02-12 — — US disclosed
EP-3110801-B1 6-ARYL-4-PHENYLAMINO-QUINAZOLINE ANALOGS AS PHOSPHOINOSITIDE-3-KINASE INHIBITORS COUNCIL SCIENT IND RES (IN) 2019-01-30 — — EP disclosed
US-20170015662-A1 6-ARYL-4-PHENYLAMINO-QUINAZOLINE ANALOGS AS PHOSPHOINOSITIDE-3-KINASE INHIBITORS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-01-19 — — US disclosed
EP-3110801-A1 6-ARYL-4-PHENYLAMINO-QUINAZOLINE ANALOGS AS PHOSPHOINOSITIDE-3-KINASE INHIBITORS COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-01-04 — — EP disclosed
WO-2015128873-A1 \"6-ARYL-4-PHENYLAMINO-QUINAZOLINE ANALOGS AS PHOSPHOINOSITIDE-3-KINASE INHIBITORS\ COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-03 — — 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 (2 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-10202374-B2 6-aryl-4-phenylamino-quinazoline analogs as phosphoinositide-3-kinase inhibitors PIK3CA, PI4KA, PDPK1 PIK3CG 5/4885PIK3CA 1/4885PIK3CD 4/4885
US-20170015662-A1 6-ARYL-4-PHENYLAMINO-QUINAZOLINE ANALOGS AS PHOSPHOINOSITIDE-3-KINASE INHIBITORS PIK3CA, PI4KA, PDPK1 PIK3CG 5/4885PIK3CA 1/4885PIK3CD 4/4885

“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.

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