SCHEMBL13043365

SCHEMBL13043365

CCc1ccc(C(=O)NC)cn1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 7/20 0.55
BAZ2B Q9UIF8 1/20 0.53
GRM5 P41594 1/20 0.48
HDAC6 Q9UBN7 4/20 0.46
HDAC2 Q92769 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC1 Q13547 2/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
USP7 Q93009 1/20 0.42
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL18929820 0.86 PLK1 (0.57) PLK1BAZ2BGRM5HDAC6HDAC2
SCHEMBL2223607 0.86 MAPT (0.46) HDAC6HDAC2HDAC8HDAC1HDAC4
SCHEMBL22692894 0.84 HPGDS (0.46) HDAC6HDAC1
SCHEMBL16560319 0.82 KDM4E (0.48) HDAC6HDAC1SMN1; SMN2HDAC4
SCHEMBL3950709 0.81 BAZ2B (0.49) PLK1BAZ2BGRM5HDAC6HDAC2
SCHEMBL12388320 0.81 KDM4E (0.50) HPGDSMN1; SMN2
SCHEMBL14023317 0.81 KCNJ1 (0.45) HPGDTSHR
SCHEMBL27981651 0.81 HCAR3 (0.42) HTTSMN1; SMN2
SCHEMBL16560318 0.80 KDM4E (0.50) BAZ2B
SCHEMBL344135 0.79 MAPT (0.58) HPGDSMN1; SMN2

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-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-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS AMGEN INC. (US) 2014-02-13 US disclosed
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2013-06-20 US disclosed
WO-2010142752-A1 JANUS KINASE INHIBITOR COMPOUNDS AND METHODS F. HOFFMANN-LA ROCHE AG (CH) 2010-12-16 WO disclosed
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use GENENTECH, INC. 2007-10-11 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 (4 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 PLK1 1764/4885BAZ2B 4858/4885GRM5 393/4885
US-20070238726-A1 Heterobicyclic pyrazole compounds and methods of use ROR1, CYP11B1, CYP11B2 PLK1 566/4885BAZ2B 1695/4885GRM5 1520/4885
US-20140045855-A1 CHROMAN DERIVATIVES AS TRPM8 INHIBITORS TRPM8, TRPM5, TRPM7 PLK1 1764/4885BAZ2B 4858/4885GRM5 393/4885
US-20130157996-A1 TRPM8 ANTAGONISTS AND THEIR USE IN TREATMENTS TRPM8, TRPM7, TRPM5 PLK1 1805/4885BAZ2B 4874/4885GRM5 208/4885

“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.