SCHEMBL12848847

SCHEMBL12848847

CCOC(Cc1ccccc1F)c1sc2ccccc2c1CN(C)C

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.34
CHRM1 P11229 2/20 0.34
HRH1 P35367 2/20 0.34
HTR2A P28223 2/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
KCNH2 Q12809 1/20 0.32
TSPO P30536 1/20 0.31
FFAR1 O14842 1/20 0.30
RIPK1 Q13546 1/20 0.30
SLC6A4 P31645 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
SCHEMBL12848718 0.66 MAPT (0.40) CYP2D6CHRM1HRH1HTR2AALDH1A1
SCHEMBL12848683 0.66 TRPM8 (0.39) CYP2D6CHRM1HRH1HTR2AALDH1A1
SCHEMBL12848400 0.65 TRPM8 (0.49) FFAR1
SCHEMBL14035768 0.65 TRPM8 (0.43) CYP2D6CHRM1HRH1KCNH2FFAR1
SCHEMBL5761538 0.64 IDO1 (0.42) CYP2D6ALDH1A1L3MBTL1TAAR1KCNH2
SCHEMBL14035764 0.64 HRH1 (0.41) CYP2D6CHRM1HRH1HTR2A
SCHEMBL11529513 0.63 TAAR1 (0.42) CYP2D6CHRM1HRH1HTR2AALDH1A1
SCHEMBL12848338 0.62 TRPM8 (0.46)
SCHEMBL27469543 0.62 IDO1 (0.40) CYP2D6ALDH1A1L3MBTL1TAAR1KCNH2
SCHEMBL12074134 0.62 TAAR1 (0.63) HTR2AALDH1A1L3MBTL1TAAR1RIPK1

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-7897781-B2 Cold menthol receptor-1 antagonists JANSSEN PHARMACEUTICA NV (BE) 2011-03-01 US disclosed
US-20080287398-A1 COLD MENTHOL RECEPTOR-1 ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2008-11-20 US disclosed
US-20080027029-A1 COLD MENTHOL RECEPTOR-1 ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2008-01-31 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 (2 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-20080027029-A1 COLD MENTHOL RECEPTOR-1 ANTAGONISTS TRPM8, TRPM5, TRPM7 CYP2D6 1625/4885CHRM1 235/4885HRH1 100/4885
US-20080287398-A1 COLD MENTHOL RECEPTOR-1 ANTAGONISTS TRPM8, TRPM5, TRPM7 CYP2D6 1625/4885CHRM1 235/4885HRH1 100/4885

“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.