SCHEMBL10101683

SCHEMBL10101683

CNC(=O)N1CC2(CNC2)C1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
NAMPT P43490 3/20 0.38
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 1/20 0.33
BAZ2B Q9UIF8 2/20 0.32
CYP1A2 P05177 1/20 0.32
USP2 O75604 1/20 0.31
CYP2D6 P10635 1/20 0.31
ALOX15 P16050 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL30592933 0.81 HSD17B10 (0.45) POLBNAMPTHSD17B10ALDH1A1CYP1A2
SCHEMBL20669147 0.80 POLB (0.56) POLBNAMPTHSD17B10ALDH1A1CYP1A2
SCHEMBL20669138 0.80 CYP2D6 (0.48) POLBNAMPTALDH1A1CYP1A2USP2
Hydrochloric Acid SCHEMBL30184174 0.79 CYP2D6 (0.47) POLBNAMPTALDH1A1CYP1A2USP2
SCHEMBL22043622 0.77 HSD17B10 (0.51) POLBNAMPTHSD17B10ALDH1A1CYP1A2
SCHEMBL20669176 0.77 HSD17B10 (0.51) POLBNAMPTHSD17B10ALDH1A1CYP1A2
SCHEMBL10101693 0.77 POLB (0.50) POLBBAZ2BUSP2
SCHEMBL2593681 0.76 SMN1; SMN2 (0.45) NAMPTHSD17B10ALDH1A1CYP1A2USP2
SCHEMBL21358327 0.75 CHRNB2 (0.47) NAMPTHSD17B10ALDH1A1CYP1A2USP2
SCHEMBL30059414 0.75 NAMPT (0.36) NAMPTHSD17B10ALDH1A1

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-20120083476-A1 HETEROARYL-SUBSTITUTED SPIROCYCLIC DIAMINE UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA NV (BE) 2012-04-05 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-20120083476-A1 HETEROARYL-SUBSTITUTED SPIROCYCLIC DIAMINE UREA MODULATORS OF FATTY ACID AMIDE HYDROLASE FAAH, FAAH2, DBH POLB 1736/4885NAMPT 497/4885HSD17B10 949/4885

“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.