SCHEMBL8341309

SCHEMBL8341309

CNC(=S)N(C(=O)Cc1ccc(OC)cc1)C12CC3CC(CC(N=S(=O)=O)(C3)C1)C2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.38
▸ P2RX2 Q9UBL9 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ NPSR1 Q6W5P4 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ HTT P42858 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ SIGMAR1 Q99720 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ P2RX7 Q99572 1/20 0.34
▸ ALOX5 P09917 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
SCHEMBL8334261 0.92 CNR2 (0.39) MEN1KMT2AMAPTLMNACNR2
SCHEMBL8392591 0.91 ALDH1A1 (0.39) ALDH1A1P2RX2MEN1KMT2ANPSR1
SCHEMBL8341128 0.90 CNR2 (0.36) ALDH1A1P2RX2MEN1KMT2AMAPT
SCHEMBL8333058 0.76 ALDH1A1 (0.39) ALDH1A1P2RX2TDP1MEN1KMT2A
SCHEMBL8341312 0.74 POLB (0.38) ALDH1A1P2RX2MEN1KMT2ANPSR1
SCHEMBL8393917 0.71 ALDH1A1 (0.40) ALDH1A1P2RX2TDP1MEN1KMT2A
SCHEMBL8334265 0.70 CNR2 (0.35) ALDH1A1P2RX2MEN1KMT2AMAPT
SCHEMBL8336897 0.69 TDP1 (0.39) ALDH1A1TDP1MEN1KMT2AMAPT
SCHEMBL8392602 0.65 POLB (0.40) ALDH1A1P2RX2MEN1KMT2ANPSR1
SCHEMBL8339579 0.65 LMNA (0.36) ALDH1A1P2RX2MEN1KMT2ANPSR1

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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