SCHEMBL28297063

SCHEMBL28297063

Cc1cnc[nH]1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.61
▸ FKBP5 Q13451 1/20 0.61
▸ CYP3A4 P08684 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ IDO1 P14902 3/20 0.42
▸ TAAR1 Q96RJ0 6/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.39
▸ ESR1 P03372 2/20 0.38
▸ ESR2 Q92731 2/20 0.38
▸ CYP19A1 P11511 2/20 0.37
▸ HPGDS O60760 1/20 0.36
▸ ADRA2C P18825 1/20 0.36
▸ LTA4H P09960 1/20 0.35

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
Bromide SCHEMBL11502650 0.92 ALDH1A1 (0.52) ALDH1A1FKBP5CYP3A4TDP1IDO1
Biphenyl SCHEMBL27655588 0.82 ALDH1A1 (0.70) ALDH1A1FKBP5CYP3A4IDO1TAAR1
SCHEMBL28244057 0.76 — —
Ammonia Solution, Strong SCHEMBL28242555 0.76 — —
Hydrochloric Acid SCHEMBL27259157 0.76 — —
SCHEMBL27531068 0.76 — —
Dimethylamine SCHEMBL4496394 0.74 — —
Oxalic Acid SCHEMBL27357937 0.71 ALDH1A1 (0.73) ALDH1A1FKBP5CYP3A4
SCHEMBL9634653 0.71 TDP1 (0.92) ALDH1A1CYP3A4TDP1ESR1ESR2
SCHEMBL27973825 0.70 ALDH1A1 (0.80) ALDH1A1FKBP5CYP3A4HRH3CYP19A1

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-109715734-A Resin combination, the manufacturing method of resin combination, prepreg, the film of resin, the metal foil of resin, metal-clad laminate and wiring plate 松下知识产权经营株式会社 2019-05-03 — — CN disclosed
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