SCHEMBL1123500

SCHEMBL1123500

COC(=O)C(Cc1cn(C)c2ccccc12)NC(=O)c1ccc(OCCN(Cc2ccccc2)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
RAB9A P51151 1/20 0.52
ADAM17 P78536 3/20 0.46
CNR2 P34972 3/20 0.42
CNR1 P21554 2/20 0.42
PTPN1 P18031 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
HTR5A P47898 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
PPARG P37231 1/20 0.39
TACR1 P25103 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
SCHEMBL1122735 0.93 ADAM17 (0.51) GAARAB9AADAM17PTPN1HTR5A
SCHEMBL1122892 0.77 PPARG (0.56) GAARAB9AADAM17KMT2AMEN1
SCHEMBL1122929 0.74 PPARG (0.59) PTPN1KMT2AMEN1PPARGTACR1
SCHEMBL1122913 0.74 PTPN1 (0.56) GAARAB9APTPN1KMT2APPARG
SCHEMBL20307267 0.73 KDM4E (0.50) ADAM17CNR2CNR1KMT2AKDM4E
SCHEMBL1123050 0.73 PTPN1 (0.69) GAARAB9APTPN1
SCHEMBL15145362 0.72 KDM4E (0.47) ADAM17CNR2CNR1KMT2AKDM4E
SCHEMBL4356072 0.72 GAA (0.68) GAARAB9ATAS1R3TAS1R1KMT2A
SCHEMBL1122721 0.72 PTPN1 (0.68) GAARAB9APTPN1PPARG
SCHEMBL1123517 0.72 PTPN1 (0.64) GAARAB9APTPN1KMT2AKDM4E

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
EP-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed
US-20060160894-A1 Benzamides as ppar modulators LABORATORIOS S.A.L.V.A.T.,S.A. (ES) 2006-07-20 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-20060160894-A1 Benzamides as ppar modulators PPARD, PPARA, PPARG GAA 3048/4885RAB9A 4567/4885ADAM17 4502/4885

“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.