SCHEMBL29059891

SCHEMBL29059891

O=C(c1ccccc1)c1c(F)[c]c2ccccn12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.43
▸ HTT P42858 1/20 0.43
▸ POLB P06746 1/20 0.41
▸ FNTA P49354 1/20 0.40
▸ FNTB P49356 1/20 0.40
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CDK4 P11802 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ ATM Q13315 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
SCHEMBL1380292 0.76 SRD5A2 (0.44) ALDH1A1HTTFNTAFNTBMEN1
SCHEMBL29140107 0.76 MEN1 (0.44) ALDH1A1HTTPOLBMEN1KMT2A
Benzophenone SCHEMBL4595056 0.64 ALDH1A1 (0.93) ALDH1A1POLBMEN1KMT2AL3MBTL1
Benzophenone SCHEMBL4820258 0.64 ALDH1A1 (0.93) ALDH1A1POLBMEN1KMT2AL3MBTL1
Benzophenone SCHEMBL4595059 0.64 ALDH1A1 (0.93) ALDH1A1POLBMEN1KMT2AL3MBTL1
SCHEMBL11267717 0.64 MAPT (0.78) ALDH1A1HTTPOLBMEN1KMT2A
SCHEMBL15452568 0.64 RXFP1 (0.67) ALDH1A1HTTFNTAFNTBMEN1
Benzophenone SCHEMBL29153438 0.62 ALDH1A1 (0.88) ALDH1A1POLBMEN1KMT2AL3MBTL1
Benzophenone SCHEMBL27758204 0.62 ALDH1A1 (0.88) ALDH1A1POLBMEN1KMT2AL3MBTL1
Benzophenone SCHEMBL6061130 0.61 ALDH1A1 (1.00) ALDH1A1POLBMEN1KMT2AL3MBTL1

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-116640135-A Preparation method of 3-carbonyl-2-fluoro substituted indolizine compound 平顶山学院 2023-08-25 — — CN claimed
CN-116640135-A Preparation method of 3-carbonyl-2-fluoro substituted indolizine compound 平顶山学院 2023-08-25 — — CN disclosed
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