SCHEMBL292701

SCHEMBL292701

CC1(C)CN(c2ccccc2C(F)(F)F)C(=O)CN1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.44
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
L3MBTL1 Q9Y468 7/20 0.40
TDP1 Q9NUW8 5/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
ALDH1A1 P00352 1/20 0.39
CYP3A4 P08684 1/20 0.37
HSD11B1 P28845 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HCAR1 Q9BXC0 3/20 0.36
NOTUM Q6P988 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
SCHEMBL292960 0.81 MEN1 (0.53) ARALDH1A1MEN1KMT2A
SCHEMBL294226 0.80 DDB1 (0.49) L3MBTL1TDP1KDM4EMAPTALDH1A1
SCHEMBL292679 0.78 HSD11B1 (0.46) KDM4EMAPTALDH1A1HSD11B1
SCHEMBL291891 0.78 LMNA (0.47) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL291655 0.77 MEN1 (0.40) ARMEN1KMT2AHCAR1NOTUM
SCHEMBL293635 0.76 RECQL (0.40) ARMEN1KMT2AHCAR1
SCHEMBL292189 0.76 ALDH1A1 (0.48) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL291894 0.76 MAPT (0.43) HTR2BTDP1KDM4EMAPTALDH1A1
SCHEMBL1583156 0.72 HTR2C (0.44) HTR2CHTR2BKDM4EMAPTHSD11B1
SCHEMBL8728249 0.71 MAPT (0.46) L3MBTL1TDP1KDM4EMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158790-B2 Cyclic amine compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-04-17 US disclosed
EP-2036896-B1 CYCLIC AMINE COMPOUND DAIICHI SANKYO CO LTD (JP) 2012-03-14 EP disclosed
US-20090286807-A1 CYCLIC AMINE COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-11-19 US disclosed
EP-2036896-A1 CYCLIC AMINE COMPOUND Daiichi Sankyo Company, Limited (JP) 2009-03-18 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-20090286807-A1 CYCLIC AMINE COMPOUND HRH3, HRH4, H1-0 AR 329/4885HTR2C 151/4885HTR2B 86/4885

“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.