SCHEMBL23929231

SCHEMBL23929231

O=Cc1cc(CCc2ccc(F)cc2)n[nH]1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 2/20 0.40
▸ KCNH2 Q12809 2/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ DAO P14920 3/20 0.40
▸ MAPT P10636 2/20 0.39
▸ GPR84 Q9NQS5 1/20 0.39
▸ TAAR1 Q96RJ0 2/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ DHFR P00374 1/20 0.35
▸ RET P07949 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ HCAR2 Q8TDS4 1/20 0.35
▸ ALDH1A1 P00352 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
SCHEMBL23929224 0.83 KCNH2 (0.44) KCNH2DAOGPR84HCAR2ALDH1A1
SCHEMBL14719236 0.75 DAO (0.57) DAOMAPTGPR84PTGS1PTGS2
SCHEMBL20897252 0.75 CA12 (0.55) DAOHCAR2
SCHEMBL24622020 0.74 PTGS1 (0.40) HTR2AKCNH2HTR2CDAOTAAR1
SCHEMBL28045657 0.70 MAPT (0.39) DAOMAPTRETKDRHCAR2
SCHEMBL14814661 0.69 CA12 (0.56) MAPTRETKDR
SCHEMBL20897239 0.69 ALPL (0.47) DAOMAPTALDH1A1
SCHEMBL28236736 0.68 HCAR2 (0.41) DAOHCAR2
SCHEMBL7437052 0.67 TAAR1 (0.68) DAOTAAR1PTGS1PTGS2
SCHEMBL16232008 0.67 DAO (0.51) DAOMAPTGPR84RETKDR

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
EP-4139275-A1 COMPOUNDS AND PHARMACEUTICAL USES THEREOF Syneurx International (Taiwan) Corp. (TW) 2023-03-01 — — EP disclosed
WO-2021213500-A1 COMPOUNDS AND PHARMACEUTICAL USES THEREOF SYNEURX INTERNATIONAL (TAIWAN) CORP. (CN) 2021-10-28 — — WO disclosed
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