SCHEMBL5511206

SCHEMBL5511206

CN1C(=O)Cc2cc(N)cc(F)c21.[Fe]

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BMPR1B O00238 3/20 0.41
BMPR1A P36894 3/20 0.41
ACVRL1 P37023 3/20 0.41
ACVR1 Q04771 3/20 0.41
TGFBR1 P36897 2/20 0.41
BRD4 O60885 1/20 0.33
MAPT P10636 1/20 0.32
ATAD2 Q6PL18 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL5004930 0.98 BMPR1B (0.42) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL3035796 0.85 SRD5A1 (0.39) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL2078451 0.80 BMPR1B (0.44) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5505340 0.80 CYP19A1 (0.37) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5501426 0.79 BMPR1B (0.34) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL26750443 0.79 BMPR1B (0.43) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL5001377 0.78 CYP19A1 (0.38) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL25318279 0.77 BMPR1B (0.42) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL21001754 0.77 BMPR1B (0.45) BMPR1BBMPR1AACVRL1ACVR1TGFBR1
SCHEMBL31178355 0.77 BMPR1B (0.42) BMPR1BBMPR1AACVRL1ACVR1TGFBR1

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-1781642-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006016221-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed