Sugi Predict

Sugi Predict / Compounds / SCHEMBL6623925

SCHEMBL6623925

SCHEMBL6623925

Cc1cc2cc(Nc3ccnc4cc(C(=O)N5CCC[C@H]5CO)sc34)ccc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.51
▸ FLT1 P17948 15/20 0.51
▸ KDR P35968 1/20 0.41
▸ SYK P43405 1/20 0.40
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ HSD11B1 P28845 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36

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
SCHEMBL6308715 1.00 EGFR (0.51) EGFRFLT1KDRSYKMAOA
SCHEMBL6625109 1.00 EGFR (0.51) EGFRFLT1KDRSYKMAOA
SCHEMBL6623860 0.92 EGFR (0.50) EGFRFLT1KDRSYKMAOA
SCHEMBL6623863 0.92 EGFR (0.50) EGFRFLT1KDRSYKMAOA
SCHEMBL6624067 0.92 EGFR (0.51) EGFRFLT1KDRSYKMAOA
SCHEMBL6304404 0.92 EGFR (0.49) EGFRFLT1KDRSYKMAOA
SCHEMBL6627143 0.92 EGFR (0.51) EGFRFLT1KDRSYKMAOA
SCHEMBL6624068 0.92 EGFR (0.51) EGFRFLT1KDRSYKMAOA
SCHEMBL6302083 0.92 EGFR (0.49) EGFRFLT1KDRSYKMAOA
SCHEMBL6304774 0.92 EGFR (0.49) EGFRFLT1KDRSYKMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1287001-B1 THIOPHENE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2004-09-29 — — EP disclosed