SCHEMBL8336185

SCHEMBL8336185

CNC(=S)NC(=O)CN1CCCC(N=S(=O)=O)C1c1ccc(OC)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.38
▸ OPRM1 P35372 1/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ TACR1 P25103 1/20 0.35
▸ UBE2N P61088 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ FPR1 P21462 1/20 0.34
▸ FPR2 P25090 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL8340133 0.94 TDP1 (0.37) TDP1OPRM1OPRK1UBE2NKDM4E
SCHEMBL8336462 0.92 OPRK1 (0.39) OPRM1OPRK1TACR1KDM4EFPR1
SCHEMBL8338913 0.85 SMN1; SMN2 (0.36) OPRM1OPRK1FPR1FPR2SMN1; SMN2
SCHEMBL8340904 0.84 GAA (0.33) TACR1RAB9ASMN1; SMN2ALDH1A1LMNA
SCHEMBL8335504 0.77 TDP1 (0.35) TDP1UBE2NKDM4ENPC1RAB9A
SCHEMBL8339931 0.71 TDP1 (0.48) TDP1KDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL8339200 0.68 DRD3 (0.36) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL8335900 0.67 TDP1 (0.46) TDP1KDM4ERAB9ASMN1; SMN2ALDH1A1
SCHEMBL8335612 0.63 LMNA (0.40) TDP1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL8335797 0.63 OPRK1 (0.41) OPRM1OPRK1KDM4EBACE1HSD17B10

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
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
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