SCHEMBL8339597

SCHEMBL8339597

CNC(=S)N(C(=O)C(CN=S(=O)=O)c1ccc(OC)cc1)C1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ CHRM2 P08172 2/20 0.36
▸ CHRM1 P11229 2/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ CHRM5 P08912 1/20 0.36
▸ CHRM3 P20309 1/20 0.36
▸ YAP1 P46937 2/20 0.36
▸ TEAD4 Q15561 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ EPHX2 P34913 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ SMN1; SMN2 Q16637 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
SCHEMBL8335851 0.81 CNR2 (0.38) KMT2AMEN1
SCHEMBL8334765 0.79 HPGD (0.37) KMT2AMEN1MAPT
SCHEMBL8334832 0.79 CNR2 (0.37) KMT2AMEN1RAB9AMAPT
SCHEMBL8391019 0.76 EPHX2 (0.51) KMT2AYAP1TEAD4NPC1RAB9A
SCHEMBL8340993 0.74 EPHX2 (0.36) KMT2AMEN1EPHX2
SCHEMBL8336540 0.74 CNR2 (0.40) KMT2A
SCHEMBL8338167 0.73 HPGD (0.39) MAPT
SCHEMBL8341066 0.72 — —
SCHEMBL8336209 0.71 GPR88 (0.35) KMT2AMEN1
SCHEMBL8334475 0.70 CNR1 (0.33) KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8245556-A — — None — — JP disclosed
US-5977177-A Substituted benzenesulfonylureas and-thioureas, processes for their preparation and use of pharmaceutical preparations based on these compounds, and medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1999-11-02 — — US disclosed
US-5880155-A TREATMENT OF CARDIOVASCULAR DISORDERS HOECHST AKTIENGESELLSCHAFT (DE) 1999-03-09 — — US disclosed
JP-H08245556-A SUBSTITUTED BENZENESULFONYLUREA AND-THIOUREA, THEIR PREPARATION AND THEIR USE FOR PHARMACEUTICAL PREPARATION BASED ON THE COMPOUNDS, AND MBDICAMENT CONTAINING THEM HOECHST AG 1996-09-24 — — JP disclosed
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