SCHEMBL27347771

SCHEMBL27347771

Fc1ccc(CBr)cc1.c1csnn1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 2/20 0.33
▸ LOXL2 Q9Y4K0 1/20 0.33
▸ CYP19A1 P11511 1/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ MIF P14174 1/20 0.32
▸ TAAR1 Q96RJ0 1/20 0.31
▸ TRPA1 O75762 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ KAT2B Q92831 1/20 0.31
▸ AGXT P21549 1/20 0.31

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
SCHEMBL28074378 0.84 GAA (0.35) ALDH1A1
SCHEMBL5110 0.76 — —
SCHEMBL15233233 0.76 — —
Hydrochloric Acid SCHEMBL26962946 0.73 IDO1 (0.50) IDO1LOXL2MIFTAAR1TRPA1
SCHEMBL22165011 0.73 IDO1 (0.50) IDO1LOXL2MIFTAAR1TRPA1
SCHEMBL512431 0.73 IDO1 (0.50) IDO1LOXL2MIFTAAR1TRPA1
SCHEMBL1835628 0.73 IDO1 (0.50) IDO1LOXL2MIFTAAR1TRPA1
SCHEMBL8015172 0.69 MAOB (0.52) IDO1LOXL2TAAR1TRPA1ALDH1A1
SCHEMBL28074379 0.69 NFE2L2 (0.41) —
SCHEMBL4303682 0.68 — —

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
CN-1040979-C Antipsychotic method NOVO NORDISK AS (DK) 1998-12-02 — — CN disclosed
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