SCHEMBL1504206

SCHEMBL1504206

CN(C)C(=O)[C@H]1CCCC(N(NC(=O)C=Cc2ccc(Cl)cc2)C(=O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.42
MAPK1 P28482 1/20 0.41
LMNA P02545 5/20 0.40
HTT P42858 3/20 0.40
GAA P10253 2/20 0.40
MAPT P10636 3/20 0.39
RECQL P46063 1/20 0.39
HDAC2 Q92769 1/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.39
UTS2R Q9UKP6 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
EGFR P00533 1/20 0.37
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
KMT2A Q03164 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
SCHEMBL4268496 0.86 KDM1A (0.39) MCHR1MAPK1LMNAHTTGAA
SCHEMBL1503903 0.78 AGER (0.40) MCHR1HTTGAAMAPTPOLB
SCHEMBL1504199 0.75 TSHR (0.36) LMNAHTTGAAMAPTRECQL
SCHEMBL1503895 0.74 F10 (0.48) POLBNPC1RAB9AKMT2A
SCHEMBL4267059 0.74 L3MBTL1 (0.32) L3MBTL1NPC1RAB9A
SCHEMBL1504207 0.74 MAPK1 (0.52) MCHR1MAPK1MAPTRECQLHDAC2
SCHEMBL1504202 0.74 MAPK1 (0.52) MCHR1MAPK1MAPTRECQLHDAC2
SCHEMBL12035790 0.73 MAPK1 (0.54) MCHR1MAPK1LMNAHTTMAPT
SCHEMBL1503995 0.73 L3MBTL1 (0.44) MAPK1LMNAGAAL3MBTL1SMN1; SMN2
SCHEMBL2934107 0.71 MAPK1 (0.47) MCHR1MAPK1LMNAHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 EP disclosed
EP-1405852-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-08-01 EP disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
EP-2343290-A1 Diamine derivatives as factor X inhibitors Daiichi Sankyo Company, Limited (JP) 2011-07-13 EP disclosed
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20090270446-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-10-29 US disclosed
US-7365205-B2 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-04-29 US disclosed
US-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 US disclosed
US-20080015215-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-01-17 US disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 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 (6 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-20090270446-A1 DIAMINE DERIVATIVES F2, TFPI, F3 MCHR1 4447/4885MAPK1 1819/4885LMNA 2682/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R MCHR1 807/4885MAPK1 1864/4885LMNA 2624/4885
US-20080015215-A1 DIAMINE DERIVATIVES C9, C1S, C1R MCHR1 807/4885MAPK1 1864/4885LMNA 2624/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MCHR1 807/4885MAPK1 1864/4885LMNA 2624/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 MCHR1 4447/4885MAPK1 1819/4885LMNA 2682/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R MCHR1 640/4885MAPK1 1758/4885LMNA 2829/4885

“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.