SCHEMBL12779366

SCHEMBL12779366

Cc1nccc2c(NC(=O)C3CCN(c4ccc(F)cc4)CC3)cccc12

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.53
USP2 O75604 3/20 0.52
TSHR P16473 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TP53 P04637 1/20 0.50
F10 P00742 6/20 0.48
F2 P00734 2/20 0.48
ELANE P08246 1/20 0.48
LMNA P02545 1/20 0.47
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 2/20 0.46
PKM P14618 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL12779379 0.92 ALDH1A1 (0.48) USP2NPSR1TP53LMNAKDM4E
SCHEMBL12779268 0.90 F10 (0.47) USP2TP53F10LMNAKDM4E
SCHEMBL12779322 0.89 DEGS1 (0.55) DEGS1USP2TSHRTP53F10
SCHEMBL12779385 0.88 KDM4E (0.52) USP2TSHRNPSR1TP53F10
SCHEMBL12779297 0.87 MRGPRX1 (0.49) USP2TP53LMNAKDM4EALDH1A1
SCHEMBL12779348 0.86 TP53 (0.50) USP2TP53F10LMNAKDM4E
SCHEMBL12779338 0.86 POLB (0.47) USP2TP53F10LMNAKDM4E
SCHEMBL12779353 0.85 CHRM4 (0.48) USP2TP53LMNAKDM4EALDH1A1
SCHEMBL12779343 0.85 NOTUM (0.47) USP2TP53LMNAKDM4EALDH1A1
SCHEMBL12779310 0.85 POLB (0.50) USP2TP53LMNAKDM4EALDH1A1

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-20110059979-A1 Piperidine/Cyclohexane Carboxamide Derivatives For Use as Vanilloid Receptor Modulators GLAXO GROUP LIMITED (GB) 2011-03-10 US disclosed
US-20110059979-A1 Piperidine/Cyclohexane Carboxamide Derivatives For Use as Vanilloid Receptor Modulators GLAXO GROUP LIMITED (GB) 2011-03-10 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-20110059979-A1 Piperidine/Cyclohexane Carboxamide Derivatives For Use as Vanilloid Receptor Modulators TRPV1, CNR1, OPRM1 DEGS1 725/4885USP2 4339/4885TSHR 654/4885

“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.