SCHEMBL10197082

SCHEMBL10197082

C=C1Cc2ccccc2S(=O)(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLCG1 P19174 1/20 0.39
NOTUM Q6P988 1/20 0.34
MAOA P21397 2/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
GPR3 P46089 1/20 0.32
HPGD P15428 1/20 0.32
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31
CA4 P22748 2/20 0.31
CA7 P43166 2/20 0.31
CA9 Q16790 2/20 0.31
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
BCHE P06276 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31

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
SCHEMBL20644286 0.79 PLCG1 (0.41) PLCG1NOTUMMAOACYP1A2KMT2A
SCHEMBL10159211 0.72 MAOA (0.40) PLCG1NOTUMMAOACYP1A2KMT2A
SCHEMBL10197078 0.71 MAOA (0.41) MAOACYP1A2KMT2AMEN1GPR3
SCHEMBL29958223 0.69 MAOA (0.54) MAOACYP1A2KMT2AMEN1GPR3
SCHEMBL29844652 0.69 MAOA (0.54) MAOACYP1A2KMT2AMEN1GPR3
SCHEMBL290638 0.69 MAOA (0.54) MAOACYP1A2KMT2AMEN1GPR3
SCHEMBL4574632 0.67 CYP1A2 (0.50) MAOACYP1A2KMT2AMEN1KDM4E
SCHEMBL29795304 0.67 CYP1A2 (0.50) MAOACYP1A2KMT2AMEN1KDM4E
Water SCHEMBL7420168 0.67 MAOA (0.53) MAOACYP1A2KMT2AMEN1GPR3
SCHEMBL10196636 0.67 GPR3 (0.44) PLCG1NOTUMKMT2AMEN1GPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263764-B2 IL-12 Modulatory compounds SYNTA PHARMACEUTICALS CORP. (US) 2012-09-11 US disclosed
US-20120021434-A1 METHOD FOR TREATING B CELL REGULATED AUTOIMMUNE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-01-26 US disclosed
US-20110294798-A1 IL-12 MODULATORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2011-12-01 US disclosed
US-20110098267-A1 TOPICAL FORMULATIONS FOR THE TREATMENT OF PSORIASIS SYNTA PHARMACEUTICALS CORPORATION (US) 2011-04-28 US disclosed
US-20090163708-A1 PROCESS FOR PREPARING MESYLATE SALTS OF IL-12 INHIBITORY COMPOUNDS SYNTA PHARMACEUTICALS CORP. (US) 2009-06-25 US disclosed
US-20070032493-A1 Method for treating B cell regulated autoimmune disorders SYNTA PHARMACEUTICALS CORP. (US) 2007-02-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110098267-A1 TOPICAL FORMULATIONS FOR THE TREATMENT OF PSORIASIS IL17A, IL23R, IL15 PLCG1 1327/4885NOTUM 1010/4885MAOA 1835/4885
US-20110294798-A1 IL-12 MODULATORY COMPOUNDS IL2, IL4, IL15 PLCG1 1267/4885NOTUM 4327/4885MAOA 2199/4885
US-20090163708-A1 PROCESS FOR PREPARING MESYLATE SALTS OF IL-12 INHIBITORY COMPOUNDS IL17A, IL23R, IL2 PLCG1 2422/4885NOTUM 4406/4885MAOA 2457/4885
US-20070032493-A1 Method for treating B cell regulated autoimmune disorders REL, NFATC1, BCL6 PLCG1 2566/4885NOTUM 3788/4885MAOA 4125/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.