SCHEMBL4228523

SCHEMBL4228523

CCN(CC1CCCC1)c1ncc(C(F)(F)F)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.40
AR P10275 1/20 0.36
CRHR1 P34998 3/20 0.36
GRM2 Q14416 1/20 0.33
FFAR2 O15552 1/20 0.32
APAF1 O14727 2/20 0.32
UBE2N P61088 2/20 0.32
IDE P14735 1/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CSF1R P07333 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31
POLB P06746 1/20 0.31
UBE2M P61081 1/20 0.31
DCUN1D1 Q96GG9 1/20 0.31

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
SCHEMBL4226917 0.88 TRPM8 (0.36) TRPM8ARCRHR1GRM2L3MBTL1
SCHEMBL4226922 0.88 TRPM8 (0.36) TRPM8ARCRHR1GRM2L3MBTL1
SCHEMBL4224248 0.83 KDM4C (0.36) TRPM8ARCRHR1L3MBTL1
SCHEMBL4223794 0.83 TRPM8 (0.43) TRPM8ARCRHR1FFAR2APAF1
SCHEMBL4228333 0.82 TRPM8 (0.41) TRPM8ARCRHR1FFAR2L3MBTL1
SCHEMBL4224281 0.82 KDM4E (0.41) TRPM8CRHR1L3MBTL1POLB
SCHEMBL4228266 0.82 KDM4E (0.41) TRPM8CRHR1L3MBTL1POLB
SCHEMBL27743154 0.80 KDM4E (0.35) TRPM8ARCRHR1L3MBTL1POLB
SCHEMBL4234057 0.77 GPBAR1 (0.37) TRPM8ARCRHR1APAF1UBE2N
SCHEMBL4222350 0.77 CETP (0.36) TRPM8APAF1UBE2NIDERECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
US-20090075968-A1 CETP inhibitors SAKAKI JUNICHI 2009-03-19 US disclosed
EP-1968941-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) Novartis AG (CH) 2008-09-17 EP disclosed
WO-2007073934-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) NOVARTIS AG (CH) 2007-07-05 WO disclosed
WO-2007073934-A1 PYRIDINYL AMINE DERIVATIVES AS INHIBITORS OF CHOLESTERYL ESTER TRANSFER PROTEIN (CETP) NOVARTIS AG (CH) 2007-07-05 WO 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-20090075968-A1 CETP inhibitors CETP, PCSK9, MTTP TRPM8 1420/4885AR 2151/4885CRHR1 2960/4885

“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.