SCHEMBL7771232

SCHEMBL7771232

COc1ccc(Nc2cc(Nc3ccc(F)c(Cl)c3)ncn2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.70
▸ KMT2A Q03164 4/20 0.70
▸ APP P05067 1/20 0.64
▸ NPC1 O15118 3/20 0.63
▸ RAB9A P51151 3/20 0.63
▸ EGFR P00533 8/20 0.56
▸ ERBB3 P21860 3/20 0.56
▸ GALR2 O43603 1/20 0.55
▸ MAPT P10636 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ AURKA O14965 1/20 0.53
▸ ERBB2 P04626 1/20 0.53
▸ INSR P06213 1/20 0.53
▸ FBP1 P09467 1/20 0.53
▸ PDGFRB P09619 1/20 0.53
▸ FLT4 P35916 1/20 0.53
▸ KDR P35968 1/20 0.53
▸ CLK1 P49759 1/20 0.53
▸ EPHB4 P54760 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
SCHEMBL7777468 0.88 EGFR (0.74) MEN1KMT2AAPPNPC1RAB9A
SCHEMBL7778702 0.86 MEN1 (0.51) MEN1KMT2AAPPNPC1RAB9A
SCHEMBL7775667 0.86 EGFR (0.60) APPEGFRERBB3MAPTSMN1; SMN2
SCHEMBL7777464 0.85 EGFR (0.61) MEN1KMT2AEGFRERBB3AURKA
SCHEMBL1387327 0.85 APP (0.62) MEN1KMT2AAPPNPC1RAB9A
SCHEMBL7778638 0.83 SYK (0.51) MEN1KMT2AAPPNPC1RAB9A
SCHEMBL7775673 0.83 EGFR (0.57) MEN1KMT2ANPC1RAB9AEGFR
SCHEMBL28056977 0.82 EGFR (0.55) MEN1KMT2AEGFRERBB3AURKA
SCHEMBL7771263 0.82 EGFR (0.52) MEN1KMT2AAPPEGFRERBB3
SCHEMBL1387236 0.81 NPC1 (0.66) MEN1KMT2AAPPNPC1EGFR

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
EP-0733045-B1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2001-08-16 — — EP claimed
US-5880130-A TREATMENT OF CELL-PROLIFERATION DISEASES ZENECA LIMITED (GB) 1999-03-09 — — US claimed
EP-0733045-B1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2001-08-16 — — EP disclosed
US-5880130-A TREATMENT OF CELL-PROLIFERATION DISEASES ZENECA LIMITED (GB) 1999-03-09 — — US disclosed
EP-0733045-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1996-09-25 — — EP disclosed
WO-1995015952-A1 4,6-DIANILINO-PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS TYROSINE KINASE INHIBITORS ZENECA LIMITED (GB) 1995-06-15 — — WO disclosed
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