SCHEMBL6118947

SCHEMBL6118947

COc1cc2nc(C)nc(Cl)c2cc1OCCCN1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 12/20 0.55
▸ EGFR P00533 5/20 0.55
▸ AURKA O14965 1/20 0.54
▸ KDR P35968 6/20 0.54
▸ FLT4 P35916 2/20 0.53
▸ ABL1 P00519 2/20 0.53
▸ CIT O14578 1/20 0.53
▸ GAK O14976 1/20 0.53
▸ EPHB6 O15197 1/20 0.53
▸ ABCC4 O15439 1/20 0.53
▸ DAPK3 O43293 1/20 0.53
▸ RIPK2 O43353 1/20 0.53
▸ NR1I2 O75469 1/20 0.53
▸ RPS6KA4 O75676 1/20 0.53
▸ STK17B O94768 1/20 0.53
▸ STK10 O94804 1/20 0.53
▸ PRKD3 O94806 1/20 0.53
▸ ABCB11 O95342 1/20 0.53
▸ MAP4K4 O95819 1/20 0.53
▸ CHEK2 O96017 1/20 0.53

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
SCHEMBL29478521 0.85 EGFR (0.67) SRCEGFRAURKAKDRFLT4
SCHEMBL2770275 0.85 EGFR (0.67) SRCEGFRAURKAKDRFLT4
SCHEMBL3530275 0.85 EGFR (0.67) SRCEGFRAURKAKDRFLT4
Hydrochloric Acid SCHEMBL27988367 0.84 EGFR (0.66) SRCEGFRAURKAKDRFLT4
SCHEMBL20336777 0.82 EGFR (0.53) SRCEGFRKDRFLT4ABL1
SCHEMBL29385684 0.82 EGFR (0.53) SRCEGFRKDRFLT4ABL1
SCHEMBL19272512 0.82 EGFR (0.58) SRCEGFRAURKAKDRFLT4
SCHEMBL21642597 0.82 KDR (0.56) SRCEGFRKDRFLT4ABL1
SCHEMBL13380202 0.81 AXL (0.65) SRCEGFRAURKAKDRRET
SCHEMBL19462039 0.80 SPIN1 (0.62) —

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-2640392-B1 SUBSTITUTED 4-(SELENOPHEN-2(OR 3)-YLAMINO)PYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LTD (IN) 2015-01-07 — — EP disclosed
US-8815879-B2 Substituted 4-(selenophen-2(or-3)-ylamino)pyrimidine compounds and methods of use thereof KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (US) 2014-08-26 — — US disclosed
US-20130266563-A1 SUBSTITUTED 4-(SELENOPHEN-2(OR-3)-YLAMINO)PYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2013-10-10 — — US disclosed
EP-2640392-A2 SUBSTITUTED 4-(SELENOPHEN-2(OR 3)-YLAMINO)PYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF Kasina Laila Innova Pharmaceuticals Private Ltd. (IN) 2013-09-25 — — EP disclosed
WO-2012066578-A2 SUBSTITUTED 4-(SELENOPHEN-2(OR 3)-YLAMINO)PYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF KASINA LAILA INNOVA PHARMACEUTICALS PRIVATE LIMITED (IN) 2012-05-24 — — 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-20130266563-A1 SUBSTITUTED 4-(SELENOPHEN-2(OR-3)-YLAMINO)PYRIMIDINE COMPOUNDS AND METHODS OF USE THEREOF RPS6, SULT1E1, SCLY SRC 442/4885EGFR 319/4885AURKA 2879/4885

“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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