SCHEMBL31295218

SCHEMBL31295218

CCOC(=O)C(=Cc1ccc(F)cc1OCc1ccccc1)N=[N+]=[N-]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 1/20 0.42
▸ FFAR1 O14842 2/20 0.40
▸ FFAR4 Q5NUL3 2/20 0.40
▸ MRGPRX4 Q96LA9 2/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PLIN1 O60240 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ PLIN5 Q00G26 1/20 0.38
▸ ABHD5 Q8WTS1 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MAOB P27338 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ PPARG P37231 2/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ CDK2 P24941 1/20 0.37

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
SCHEMBL23170323 0.84 MAPT (0.37) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL29812874 0.84 MAPT (0.37) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL29813127 0.82 MAPT (0.38) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL23170014 0.82 MAPT (0.38) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL31530823 0.81 SRD5A2 (0.40) KMT2ALMNAMEN1MAPTALDH1A1
SCHEMBL22620595 0.80 MAPT (0.44) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL38658948 0.79 NR1H4 (0.39) NR1H4HDAC8KMT2ALMNAMEN1
SCHEMBL20536401 0.79 MAPT (0.41) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL20536399 0.79 MAPT (0.41) KMT2ALMNAMEN1PLIN1POLB
SCHEMBL22620737 0.79 MAPT (0.41) KMT2ALMNAMEN1PLIN1POLB

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-119698412-A 5-HT2A receptor agonist, and preparation method and application thereof 上海翊石医药科技有限公司 2025-03-25 — — CN disclosed
WO-2025021120-A1 5-HT2A RECEPTOR AGONIST, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2025-01-30 — — WO disclosed
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