SCHEMBL27527790

SCHEMBL27527790

Cc1c(Br)ccc2cc(C(=O)O)[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.53
▸ HSD17B10 Q99714 3/20 0.53
▸ ALDH1A1 P00352 3/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ USP2 O75604 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ EIF4A3 P38919 2/20 0.50
▸ GPR35 Q9HC97 2/20 0.46
▸ PIN1 Q13526 1/20 0.46
▸ APEX1 P27695 2/20 0.44
▸ KDM4E B2RXH2 4/20 0.42
▸ DAO P14920 2/20 0.42
▸ MAPT P10636 1/20 0.42
▸ SRD5A2 P31213 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ RHEB Q15382 2/20 0.41
▸ XDH P47989 1/20 0.41
▸ SMAD3 P84022 1/20 0.40
▸ F7 P08709 1/20 0.39
▸ F3 P13726 1/20 0.39

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
SCHEMBL3094576 0.83 HSD17B10 (0.56) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL30817101 0.83 HSD17B10 (0.56) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL4040538 0.80 CDK1 (0.54) HPGDHSD17B10ALDH1A1MEN1KMT2A
SCHEMBL28740680 0.80 HPGD (0.53) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL27896963 0.80 HPGD (0.53) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL3599395 0.80 EIF4A3 (0.57) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL3605104 0.80 HPGD (0.53) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL8985835 0.78 HPGD (0.60) HPGDHSD17B10ALDH1A1MEN1USP2
SCHEMBL6141633 0.76 HRH4 (0.71) HRH4
SCHEMBL3722103 0.76 HSD17B10 (0.60) HPGDHSD17B10ALDH1A1MEN1USP2

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
CN-1245405-C Piperazine derivatives HOFFMANN LA ROCHE (CH) 2006-03-15 — — CN disclosed
CN-1529706-A Piperazine derivatives - 2004-09-15 — — CN disclosed
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