SCHEMBL4924719

SCHEMBL4924719

CS(=O)(=O)N1CCc2c(cc(-c3ccc(C(F)(F)F)cc3)c(=O)n2CC2CCC2)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.44
CREBBP Q92793 1/20 0.44
CNR2 P34972 2/20 0.40
CTSS P25774 15/20 0.39
CD74 P04233 6/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
SCN9A Q15858 1/20 0.37

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
SCHEMBL14144734 0.89 BRD4 (0.46) BRD4CREBBPCNR2
SCHEMBL4923461 0.87 CNR2 (0.47) BRD4CREBBPCNR2KMT2A
SCHEMBL4926420 0.84 BRD4 (0.41) BRD4CREBBPCNR2KMT2A
SCHEMBL14113974 0.84 BRD4 (0.51) BRD4CREBBPCNR2
SCHEMBL4923871 0.83 CREBBP (0.64) BRD4CREBBPCTSSSCN9A
SCHEMBL4929940 0.82 BRD4 (0.66) BRD4CREBBPCNR2CTSSCD74
SCHEMBL4924516 0.82 CNR2 (0.43) BRD4CREBBPCNR2KMT2A
SCHEMBL4921014 0.82 CNR2 (0.44) BRD4CREBBPCNR2
SCHEMBL4923915 0.81 BRD4 (0.49) BRD4CREBBPCNR2
SCHEMBL4914588 0.81 BRD4 (0.50) BRD4CREBBPCNR2SCN9A

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 BRD4 407/4885CREBBP 3109/4885CNR2 2/4885

“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.