SCHEMBL12736660

SCHEMBL12736660

CC(F)(F)CS(=O)(=O)Nc1cccc(-c2ccc(/C=C/c3nc(-c4ccc(Cl)cc4Cl)cn3Cc3ccc(C(=O)O)cc3)cc2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.36
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 1/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ENPP2 Q13822 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
ITGB3 P05106 1/20 0.32
ITGAV P06756 1/20 0.32
SYK P43405 1/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
PTGER4 P35408 3/20 0.32
PTGDR Q13258 3/20 0.32
F2 P00734 1/20 0.32
CPT1A P50416 1/20 0.32

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
SCHEMBL1676527 0.95 RAB9A (0.37) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1676523 0.95 RAB9A (0.37) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1483845 0.90 PPARA (0.38) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1483842 0.90 PPARA (0.38) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1482005 0.90 P2RX7 (0.39) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1482001 0.90 P2RX7 (0.39) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1676017 0.89 KDM4E (0.38) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1676015 0.89 KDM4E (0.38) RAB9ANPC1KDM4ECRHBPCRHR2
SCHEMBL1676579 0.89 DRD2 (0.40) F2DRD2POLB
SCHEMBL1676577 0.89 DRD2 (0.40) F2DRD2POLB

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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 US disclosed
US-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use TRANSTECH PHARMA, INC. (US) 2011-04-21 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 (1 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-20110092553-A1 Substituted Azole Derivatives, Compositions, and Methods of Use PTPRO, PTPN5, PTPRE RAB9A 3396/4885NPC1 3228/4885KDM4E 733/4885

“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.