SCHEMBL1504154

SCHEMBL1504154

CN(C)C(=O)[C@H]1CC[C@H](NC(=O)c2cc(=O)c3cc(Cl)ccc3o2)[C@H](NC(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.52
ALDH1A1 P00352 1/20 0.47
MAOB P27338 1/20 0.44
MCHR1 Q99705 1/20 0.44
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL4261288 0.88 F10 (0.49) F10ALDH1A1MAOBMCHR1MAPT
SCHEMBL6362946 0.85 F10 (0.44) F10ALDH1A1MAOBMCHR1MAPT
SCHEMBL1253539 0.80 F10 (0.85) F10
SCHEMBL3470508 0.80 F10 (0.85) F10
SCHEMBL3470505 0.80 F10 (0.85) F10
Hydrochloric Acid SCHEMBL1504069 0.79 F10 (0.83) F10
SCHEMBL1504157 0.78 ALDH1A1 (0.46) F10ALDH1A1MAOBMCHR1MAPT
SCHEMBL1503894 0.76 F10 (0.67) F10
SCHEMBL1503970 0.75 F10 (0.66) F10
SCHEMBL1503873 0.74 F10 (0.70) F10

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
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20100093785-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-15 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 (7 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 F10 4/4885ALDH1A1 793/4885MAOB 161/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R F10 196/4885ALDH1A1 3319/4885MAOB 2147/4885
US-20080015215-A1 DIAMINE DERIVATIVES C9, C1S, C1R F10 196/4885ALDH1A1 3319/4885MAOB 2147/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R F10 196/4885ALDH1A1 3319/4885MAOB 2147/4885
US-20100093785-A1 DIAMINE DERIVATIVES C9, C1S, C1R F10 72/4885ALDH1A1 3529/4885MAOB 2668/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 F10 4/4885ALDH1A1 793/4885MAOB 161/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R F10 138/4885ALDH1A1 3734/4885MAOB 2497/4885

“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.