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SCHEMBL7096066

SCHEMBL7096066

COC[C@H]1CCCN1C(=O)c1cc2nccc(Nc3ccc4[nH]c(C)cc4c3)c2s1.Cc1cc2cc(Nc3ccnc4cc(C(=O)N5CCC(O)C5)sc34)ccc2[nH]1.Cc1cc2cc(Nc3ccnc4cc(C(=O)N5CCC(O)C5)sc34)ccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FLT1 P17948 9/20 0.44
▸ EGFR P00533 8/20 0.44
▸ SYK P43405 6/20 0.37
▸ KDR P35968 3/20 0.36
▸ MET P08581 1/20 0.36
▸ CAMK1D Q8IU85 1/20 0.35
▸ BCL6 P41182 1/20 0.35
▸ PLAT P00750 1/20 0.35
▸ ROCK2 O75116 1/20 0.35

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
SCHEMBL7096067 1.00 FLT1 (0.44) FLT1EGFRSYKKDRMET
SCHEMBL6304774 0.94 EGFR (0.49) FLT1EGFRSYKKDRCAMK1D
SCHEMBL6302083 0.94 EGFR (0.49) FLT1EGFRSYKKDRCAMK1D
SCHEMBL6304404 0.94 EGFR (0.49) FLT1EGFRSYKKDRCAMK1D
SCHEMBL6309330 0.89 FLT1 (0.51) FLT1EGFRSYKKDRMET
SCHEMBL6302384 0.89 FLT1 (0.51) FLT1EGFRSYKKDRMET
SCHEMBL6302403 0.89 FLT1 (0.51) FLT1EGFRSYKKDRMET
SCHEMBL6624001 0.88 FLT1 (0.47) FLT1EGFRSYKKDR
SCHEMBL6623999 0.88 FLT1 (0.47) FLT1EGFRSYKKDR
SCHEMBL6624506 0.88 FLT1 (0.47) FLT1EGFRSYKKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1287001-A1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2003-03-05 — — EP disclosed
WO-2001094353-A1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 2001-12-13 — — WO disclosed