SCHEMBL4949094

SCHEMBL4949094

CC1CCC(C(C)C)C(C(=O)NCc2ccccn2)C1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
KDM4E B2RXH2 1/20 0.52
CYP3A4 P08684 4/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C9 P11712 2/20 0.52
LMNA P02545 1/20 0.52
CYP2D6 P10635 1/20 0.52
ALDH1A1 P00352 3/20 0.49
CYP2C19 P33261 1/20 0.49
HPGD P15428 2/20 0.49
RECQL P46063 1/20 0.49
MAPK1 P28482 2/20 0.48
TSHR P16473 1/20 0.48
POLB P06746 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
SCHEMBL2628659 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL1159800 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL29007016 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL4132345 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL29533375 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL23062653 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL529952 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL31658232 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL31486820 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9
SCHEMBL10044144 0.90 TRPM8 (0.52) TRPM8SMN1; SMN2CYP3A4CYP1A2CYP2C9

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-20130281387-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2013-10-24 US disclosed
WO-2012054528-A2 CHEMOSENSORY RECEPTOR LIGAND-BASED THERAPIES ELCELYX THERAPEUTICS, INC. (US) 2012-04-26 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-20130281387-A1 Chemosensory Receptor Ligand-Based Therapies GPR119, TAS1R2, TAS2R1 TRPM8 282/4885SMN1; SMN2 2361/4885KDM4E 4693/4885

“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.