SCHEMBL6396185

SCHEMBL6396185

Cc1cc(C(=O)O)nc(N2CCC(c3ccccc3)CC2)n1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 16/20 0.69
TTR P02766 11/20 0.59
KDM4E B2RXH2 1/20 0.53
USP2 O75604 1/20 0.53
HPGD P15428 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
HSD17B10 Q99714 1/20 0.53
PPARG P37231 1/20 0.52

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
SCHEMBL6395715 0.88 RBP4 (0.69) RBP4TTRKDM4EUSP2HPGD
SCHEMBL27680981 0.82 KDM4E (0.60) RBP4TTRKDM4EUSP2HPGD
SCHEMBL6395920 0.81 NAPEPLD (0.52) RBP4KDM4EHPGDHSD17B10
SCHEMBL13494044 0.81 KDM4E (0.81) RBP4TTRKDM4EUSP2HPGD
SCHEMBL27681034 0.79 RBP4 (0.56) RBP4TTRKDM4EUSP2HPGD
SCHEMBL1179851 0.79 RBP4 (0.59) RBP4TTRKDM4EUSP2HPGD
SCHEMBL24851277 0.78 GBA1 (0.58)
SCHEMBL12552670 0.78 RBP4 (0.55) RBP4TTRKDM4EUSP2HPGD
SCHEMBL30637298 0.78 RBP4 (0.64) RBP4TTRKDM4EUSP2HPGD
SCHEMBL5216228 0.78 RBP4 (0.57) RBP4TTRKDM4EUSP2HPGD

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-20050282824-A1 Substituted pyrimidines as inhibitors of bacterial type III protein secretion systems LI XIAOBING 2005-12-22 US disclosed
WO-2005113514-A2 SUBSTITUTED PYRIMIDINES AS INHIBITORS OF BACTERIAL TYPE III PROTEIN SECRETION SYSTEMS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-12-01 WO 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-20050282824-A1 Substituted pyrimidines as inhibitors of bacterial type III protein secretion systems UMPS, NUDT14, NUDT5 RBP4 3773/4885TTR 4357/4885KDM4E 4248/4885

“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.