SCHEMBL3973791

SCHEMBL3973791

CCN(CC)Cc1cccn1C

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.44
HSD11B1 P28845 2/20 0.41
CYP3A4 P08684 2/20 0.41
HRH3 Q9Y5N1 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
MAPT P10636 2/20 0.37
PKM P14618 1/20 0.36
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL385866 0.78 HSD11B1 (0.46) TRPM8HSD11B1CYP3A4MEN1KMT2A
SCHEMBL2975901 0.77 ALDH1A1 (0.38) TRPM8HSD11B1CYP3A4MEN1KMT2A
SCHEMBL256678 0.75
SCHEMBL18254049 0.73
Fluoride SCHEMBL30330051 0.73
SCHEMBL10103709 0.72 MEN1 (0.44) CYP3A4MEN1KMT2AALDH1A1CYP2D6
SCHEMBL7072643 0.71
SCHEMBL16708778 0.71 HSD11B1 (0.44) TRPM8HSD11B1CYP3A4MEN1KMT2A
Cyanide SCHEMBL30330500 0.70 ALDH1A1 (0.40) CYP3A4MEN1KMT2AALDH1A1CYP2D6
Bromide SCHEMBL27799185 0.70 CYP3A4 (0.43) CYP3A4MEN1KMT2AALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7547790-B2 Optically active 4,4-di-substituted oxazolidine derivative and method for producing same SANKYO COMPANY, LIMITED (JP) 2009-06-16 US disclosed
US-20080108828-A1 Optically Active 4,4-Di-Substituted Oxazolidine Derivative and Method for Producing Same SANKYO COMPANY, LIMITED (JP) 2008-05-08 US disclosed
EP-1806344-A1 OPTICALLY ACTIVE 4,4-DISUBSTITUTED OXAZOLIDINE DERIVATIVE AND METHOD FOR PRODUCING SAME Sankyo Company, Limited (JP) 2007-07-11 EP 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-20080108828-A1 Optically Active 4,4-Di-Substituted Oxazolidine Derivative and Method for Producing Same CBR3, C9, COX6C TRPM8 3861/4885HSD11B1 1740/4885CYP3A4 6/4885

“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.