SCHEMBL1503875

SCHEMBL1503875

COC(=O)C(=O)Nc1ncc(Cl)s1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 2/20 0.48
ALOX15 P16050 1/20 0.48
GPR35 Q9HC97 1/20 0.42
FPR2 P25090 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
KMT2A Q03164 1/20 0.39
RELA Q04206 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
IDH2 P48735 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL966406 0.79 ALOX15 (0.53) FFAR2ALOX15MEN1MAPTKMT2A
SCHEMBL16086080 0.77 ALOX15 (0.54) FFAR2ALOX15MEN1MAPTNFKB1
SCHEMBL28089066 0.76 FFAR2 (0.50) FFAR2ALOX15FPR2MEN1MAPT
SCHEMBL27545748 0.75 ALOX15 (0.53) FFAR2ALOX15MEN1MAPTNFKB1
SCHEMBL12545447 0.75 CCNE1 (0.66) FFAR2ALOX15MEN1MAPTKMT2A
SCHEMBL6279225 0.75 FFAR2 (0.49) FFAR2ALOX15
SCHEMBL1341811 0.72 SMN1; SMN2 (0.48) MEN1MAPTRAB9AKMT2ASMN1; SMN2
SCHEMBL5837008 0.72 SMN1; SMN2 (0.56) FFAR2ALOX15RAB9ASMN1; SMN2ALDH1A1
SCHEMBL1342717 0.72 FFAR2 (0.44) FFAR2MAPTRAB9AKMT2ASMN1; SMN2
SCHEMBL5839769 0.71 ALOX15 (0.49) FFAR2ALOX15MEN1MAPTRAB9A

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 50 patents — showing the first 20. 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-1577301-B1 Antithrombotic diaminocyclohexane derivatives DAIICHI SANKYO CO LTD (JP) 2012-09-12 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-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US 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-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20060252837-A1 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 PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 US disclosed
CN-1826333-A Diamine derivatives DAIICHI SEIYAKU CO (JP) 2006-08-30 CN disclosed
CN-1751025-A Diamine derivatives DAIICHI SEIYAKU CO (JP) 2006-03-22 CN disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
EP-1577302-A1 NOVEL ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 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-20060252837-A1 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 F2, C1S, C9 FFAR2 642/4885ALOX15 838/4885GPR35 2800/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R FFAR2 478/4885ALOX15 872/4885GPR35 2534/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R FFAR2 478/4885ALOX15 872/4885GPR35 2534/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R FFAR2 478/4885ALOX15 872/4885GPR35 2534/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 FFAR2 4198/4885ALOX15 3326/4885GPR35 4226/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R FFAR2 532/4885ALOX15 824/4885GPR35 2475/4885

“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.