SCHEMBL14768708

SCHEMBL14768708

CC(C)N1CCCC2(CCN(C)C2)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 5/20 0.44
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 10/20 0.38
TSHR P16473 7/20 0.38
CYP2D6 P10635 6/20 0.38
CYP2C9 P11712 3/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP2C19 P33261 4/20 0.38
ALDH1A1 P00352 1/20 0.35
HIF1A Q16665 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAPK1 P28482 1/20 0.33

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
SCHEMBL10128467 0.94 USP2 (0.49) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL10128592 0.92 CYP2D6 (0.38) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL10168674 0.89 CYP3A4 (0.41) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL14768453 0.86 USP2 (0.38) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL10111444 0.86 CYP2D6 (0.39) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL18705142 0.85 USP2 (0.44) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL25571376 0.84 CYP2D6 (0.36) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL10094137 0.82 CYP3A4 (0.34) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL24576857 0.81 CYP2D6 (0.39) USP2CYP1A2CYP3A4TSHRCYP2D6
SCHEMBL14768435 0.81 CYP2D6 (0.39) USP2CYP1A2CYP3A4TSHRCYP2D6

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives Centro Nacional de Investigaceiones Oncologicas (CNIO) (ES) 2013-03-14 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-20130065883-A1 Triazolo [4, 5- B] Pyridin Derivatives PIM1, PIM3, PIM2 USP2 4138/4885CYP1A2 1252/4885CYP3A4 532/4885

“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.