SCHEMBL4921014

SCHEMBL4921014

O=c1c(-c2ccc(C(F)(F)F)cc2)cc2c(n1CC1CCC1)CCCC2

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 0.44
CNR1 P21554 18/20 0.44
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40

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
SCHEMBL4916514 0.97 CNR2 (0.48) CNR2CNR1
SCHEMBL4925689 0.88 BRD4 (0.46) CNR2CNR1BRD4CREBBP
SCHEMBL14144904 0.87 CNR2 (0.45) CNR2CNR1BRD4CREBBP
SCHEMBL4924732 0.86 RIPK3 (0.38) BRD4CREBBP
SCHEMBL4925439 0.86 BRD4 (0.48) CNR2CNR1BRD4CREBBP
SCHEMBL4782213 0.85 CNR2 (0.53) CNR2CNR1BRD4CREBBP
SCHEMBL4929737 0.84 CNR2 (0.47) CNR2CNR1BRD4CREBBP
SCHEMBL4926581 0.84 CNR2 (0.54) CNR2CNR1
SCHEMBL4914775 0.83 CNR2 (0.48) CNR2CNR1BRD4CREBBP
SCHEMBL4924719 0.82 BRD4 (0.44) CNR2BRD4CREBBP

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
WO-2008079316-A1 TETRAHYDROQUINOLINONES, TETRAHYDRONAPHTHYRIDONES AND DERIVATIVES THEREOF CARA THERAPEUTICS, INC. (US) 2008-07-03 WO disclosed
US-20080161340-A1 Tetrahydroquinilinones, tetrahydronaphthyridones and derivatives thereof CARA THERAPEUTICS, INC. (US) 2008-07-03 US disclosed
US-20080161340-A1 Tetrahydroquinilinones, tetrahydronaphthyridones and derivatives thereof CARA THERAPEUTICS, INC. (US) 2008-07-03 US disclosed
US-20080161340-A1 Tetrahydroquinilinones, tetrahydronaphthyridones and derivatives thereof CARA THERAPEUTICS, INC. (US) 2008-07-03 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-20080161340-A1 Tetrahydroquinilinones, tetrahydronaphthyridones and derivatives thereof CNR1, CNR2, TRPV1 CNR2 2/4885CNR1 1/4885BRD4 407/4885

“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.