SCHEMBL12204580

SCHEMBL12204580

Cc1ccc(C(=O)Nc2ccc3c(c2)CS(=O)(=O)C3)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 11/20 0.66
▸ RAB9A P51151 11/20 0.66
▸ MAPT P10636 7/20 0.66
▸ SMN1; SMN2 Q16637 6/20 0.66
▸ ALDH1A1 P00352 3/20 0.66
▸ NFKB1 P19838 2/20 0.66
▸ NFKB2 Q00653 2/20 0.66
▸ RELA Q04206 2/20 0.66
▸ TP53 P04637 2/20 0.53
▸ CA12 O43570 2/20 0.52
▸ CA9 Q16790 2/20 0.52
▸ CA2 P00918 1/20 0.52
▸ CA7 P43166 1/20 0.52
▸ TMPRSS2 O15393 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.51
▸ HPGD P15428 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51

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
SCHEMBL15214341 0.81 RAB9A (0.71) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL18122080 0.79 MAOA (0.54) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL6295061 0.77 RAB9A (0.69) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL15214321 0.76 RAB9A (1.00) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL12310125 0.76 RAB9A (1.00) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL822378 0.76 RAB9A (1.00) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL14580374 0.76 RAB9A (1.00) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL27181403 0.76 RAB9A (1.00) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL19232055 0.75 KMT2A (0.65) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1947842 0.74 NPC1 (0.80) NPC1RAB9AMAPTSMN1; SMN2ALDH1A1

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
US-20140235619-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO INC. (CA) 2014-08-21 — — US disclosed
US-20140235619-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO INC. (CA) 2014-08-21 — — US disclosed
US-20110251182-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO, INC. (CA) 2011-10-13 — — US disclosed
US-20110251182-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES NONO, INC. (CA) 2011-10-13 — — 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 (2 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-20110251182-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES TRPM7, TRPM8, TRPM6 NPC1 496/4885RAB9A 2725/4885MAPT 3464/4885
US-20140235619-A1 AGENTS AND METHODS FOR TREATING ISCHEMIC AND OTHER DISEASES TRPM7, TRPM8, TRPM6 NPC1 496/4885RAB9A 2725/4885MAPT 3464/4885

“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.

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