SCHEMBL11132471

SCHEMBL11132471

Cc1ccc(S(=O)(=O)N=S(c2ccccc2)C(C)C)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 1.00
▸ KDM4E B2RXH2 3/20 1.00
▸ MAPT P10636 2/20 1.00
▸ TDP1 Q9NUW8 1/20 1.00
▸ KMT2A Q03164 3/20 0.65
▸ MEN1 O00255 2/20 0.65
▸ LMNA P02545 2/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ CYP2C19 P33261 1/20 0.53
▸ PIR O00625 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ RECQL P46063 1/20 0.45
▸ F2 P00734 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ C5AR1 P21730 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
SCHEMBL9633894 0.80 KMT2A (0.73) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL10925804 0.80 ALDH1A1 (0.66) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17996453 0.79 KMT2A (1.00) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17015171 0.79 KMT2A (1.00) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17996448 0.76 LMNA (0.80) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17996450 0.75 LMNA (1.00) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL2610980 0.75 CYP2C19 (0.61) ALDH1A1KDM4EMAPTTDP1KMT2A
Toluene SCHEMBL7060116 0.75 KMT2A (0.65) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17996451 0.74 MEN1 (0.63) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL17996449 0.74 LMNA (0.76) ALDH1A1KDM4EMAPTTDP1KMT2A

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
JP-58090579-A — — None — — JP disclosed
JP-S5890579-A PREPARATION OF VINYL SULFIDE WAKO PURE CHEM IND LTD 1983-05-30 — — JP disclosed
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