SCHEMBL15467331

SCHEMBL15467331

OC1(c2ccc(C(F)(F)F)c(F)c2)CCOc2cccnc21

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 10/20 0.38
HDAC1 Q13547 2/20 0.37
HDAC3 O15379 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
TRPM8 Q7Z2W7 2/20 0.37
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
CTNNB1 P35222 1/20 0.35
WNT3A P56704 1/20 0.35
MAP3K14 Q99558 2/20 0.33
P2RX7 Q99572 1/20 0.32

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
SCHEMBL15467717 0.85 PDE2A (0.38) PDE2AHDAC1HDAC3HDAC2HDAC6
SCHEMBL15467719 0.85 PDE2A (0.38) PDE2AHDAC1HDAC3HDAC2HDAC6
Hydrochloric Acid SCHEMBL16413785 0.84 PDE2A (0.37) PDE2AHDAC1HDAC3HDAC2HDAC6
Hydrochloric Acid SCHEMBL15568022 0.84 PDE2A (0.37) PDE2AHDAC1HDAC3HDAC2HDAC6
SCHEMBL15467483 0.84 MAP3K14 (0.39) PDE2ATRPM8MAP3K14P2RX7
SCHEMBL15466993 0.84 TRPM8 (0.42) PDE2ATRPM8P2RX7
SCHEMBL15467986 0.82 TRPM8 (0.37) PDE2ATRPM8CTNNB1WNT3AMAP3K14
SCHEMBL15468024 0.80 MAP3K14 (0.38) TRPM8CYP11B1CYP11B2CTNNB1WNT3A
SCHEMBL15467083 0.79 TRPM8 (0.40) PDE2ATRPM8P2RX7
SCHEMBL16421212 0.78 TRPM8 (0.39) PDE2AHDAC1HDAC3HDAC2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952009-B2 Chroman derivatives as TRPM8 inhibitors AMGEN INC. (US) 2015-02-10 US disclosed
US-8952009-B2 Chroman derivatives as TRPM8 inhibitors AMGEN INC. (US) 2015-02-10 US disclosed
US-8952009-B2 Chroman derivatives as TRPM8 inhibitors AMGEN INC. (US) 2015-02-10 US disclosed
US-20150031668-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC (US) 2015-01-29 US disclosed
US-20150031668-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC (US) 2015-01-29 US disclosed
US-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC. (US) 2014-02-13 US disclosed
WO-2014025651-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC. (US) 2014-02-13 WO disclosed
US-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC. (US) 2014-02-13 US disclosed
US-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC. (US) 2014-02-13 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-20150031668-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS TRPM8, TRPM5, TRPM7 PDE2A 891/4885HDAC1 831/4885HDAC3 965/4885
US-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS TRPM8, TRPM5, TRPM7 PDE2A 891/4885HDAC1 831/4885HDAC3 965/4885

“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.