SCHEMBL30002818

SCHEMBL30002818

COc1cc(F)ccc1S(=O)(=O)Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 2/20 0.66
▸ KDM4E B2RXH2 3/20 0.47
▸ PKM P14618 2/20 0.47
▸ TSHR P16473 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ HTT P42858 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ ALPL P05186 1/20 0.40
▸ PTGES2 Q9H7Z7 1/20 0.39

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
SCHEMBL1817556 1.00 TRPV4 (0.66) TRPV4KDM4EPKMTSHRSMN1; SMN2
SCHEMBL1127669 0.85 KDM4E (0.59) TRPV4KDM4ETSHRSMN1; SMN2HTT
SCHEMBL27589372 0.81 KDM4E (0.47) TRPV4KDM4EPKMTSHRSMN1; SMN2
SCHEMBL28755848 0.81 TSHR (0.52) KDM4EPKMTSHRSMN1; SMN2HTT
SCHEMBL5406327 0.81 TRPV4 (0.61) TRPV4KDM4ETSHRHTTALDH1A1
SCHEMBL533956 0.79 TRPV4 (0.68) TRPV4KDM4EPKMTSHRSMN1; SMN2
SCHEMBL29482639 0.79 TRPV4 (0.68) TRPV4ALDH1A1CYP1A2CYP3A4ALPL
SCHEMBL29420268 0.79 TRPV4 (1.00) TRPV4KDM4ETSHRMEN1ALDH1A1
SCHEMBL2947794 0.79 TRPV4 (1.00) TRPV4KDM4ETSHRMEN1ALDH1A1
SCHEMBL74997 0.79 TRPV4 (0.68) TRPV4ALDH1A1CYP1A2CYP3A4ALPL

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025136811-A1 CHEMICAL COMPOUNDS AND USES THEREOF IDEAYA BIOSCIENCES, INC. (US) 2025-06-26 — — WO disclosed
CN-115232144-B Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof 长春金赛药业有限责任公司 2024-04-02 — — CN disclosed
CN-115232144-A Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-10-25 — — CN disclosed
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