SCHEMBL4669960

SCHEMBL4669960

CC(O)c1ccc(NC(=O)C(=O)c2c(-c3ccccc3)[nH]c3ccccc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.51
EGFR P00533 1/20 0.48
PIK3CA P42336 1/20 0.48
ALDH1A1 P00352 1/20 0.48
PAX8 Q06710 1/20 0.47
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45

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
SCHEMBL4638436 0.81 RAB9A (0.61) POLBMAPTALDH1A1RAB9A
SCHEMBL4640537 0.81 POLB (0.53) POLBMAPTALDH1A1PAX8
SCHEMBL4640324 0.80 POLB (0.52) POLBMAPTEGFRALDH1A1PAX8
SCHEMBL4669963 0.79 POLB (0.63) POLBMAPTALDH1A1PAX8NPC1
SCHEMBL4638446 0.77 NPC1 (0.51) POLBMAPTALDH1A1NPC1RAB9A
SCHEMBL16146240 0.76 POLB (0.63) POLBMAPTALDH1A1PAX8
SCHEMBL4640689 0.75 BRD4 (0.47) POLBMAPTALDH1A1NPC1RAB9A
SCHEMBL4565523 0.73 CHRNA7 (0.49) POLBMAPTALDH1A1NPC1RAB9A
SCHEMBL30791422 0.73 POLB (0.70) POLBMAPTALDH1A1PAX8
SCHEMBL4671962 0.72 PDGFRB (0.66) POLBMAPTRAB9A

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-1888063-A1 ANTIFUNGAL AGENTS F2G Ltd. (GB) 2008-02-20 EP claimed
WO-2006123145-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2006-11-23 WO claimed