SCHEMBL31738419

SCHEMBL31738419

Cc1cc(C(=O)c2ccccc2)cc(C)c1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.56
▸ ATM Q13315 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ CNR1 P21554 2/20 0.49
▸ CNR2 P34972 2/20 0.49
▸ GABRA1 P14867 1/20 0.49
▸ GABRB1 P18505 1/20 0.49
▸ CES2 O00748 1/20 0.48
▸ CES1 P23141 1/20 0.48
▸ SRD5A2 P31213 1/20 0.48
▸ ABCC9 O60706 2/20 0.46
▸ ABCC8 Q09428 2/20 0.46
▸ KCNJ11 Q14654 2/20 0.46
▸ KCNJ8 Q15842 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ PBRM1 Q86U86 1/20 0.46
▸ MEN1 O00255 1/20 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
SCHEMBL4350647 0.87 HTT (0.43) ALDH1A1TDP1CES2CES1SRD5A2
SCHEMBL29151349 0.84 LTA4H (0.52) ALDH1A1ATMTDP1CES2CES1
SCHEMBL9323609 0.83 ALDH1A1 (0.61) ALDH1A1ATMTDP1L3MBTL1CNR1
SCHEMBL9618894 0.82 GABRA1 (0.59) ALDH1A1ATMTDP1L3MBTL1CNR1
SCHEMBL7815583 0.81 ATM (0.55) ALDH1A1ATMTDP1L3MBTL1CES2
SCHEMBL27893118 0.80 ALDH1A1 (0.56) ALDH1A1ATMTDP1L3MBTL1CNR1
SCHEMBL6390145 0.80 ALDH1A1 (0.56) ALDH1A1ATMTDP1L3MBTL1CNR1
SCHEMBL3974706 0.79 ALDH1A1 (0.61) ALDH1A1ATMTDP1L3MBTL1CNR1
Benzophenone SCHEMBL2156249 0.78 ALDH1A1 (0.74) ALDH1A1ATMTDP1L3MBTL1CES2
SCHEMBL3349765 0.78 ATM (0.84) ALDH1A1ATMTDP1L3MBTL1CNR1

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-121021334-A Synthesis process of 4-fluoro-3, 5-dimethylbenzohydrazine hydrochloride 南京琦诺医药科技有限公司 2025-11-28 — — CN disclosed
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