SCHEMBL5206232

SCHEMBL5206232

[CH2]CCCC(=O)N(CCCC)CCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP3 P08254 1/20 0.48
MMP8 P22894 1/20 0.48
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA9 Q16790 2/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 4/20 0.45
HPGD P15428 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
NCOR2 Q9Y618 1/20 0.43
SIGMAR1 Q99720 1/20 0.40
KDM5A P29375 5/20 0.40
KDM4C Q9H3R0 4/20 0.40
ALDH2 P05091 1/20 0.38
PHF8 Q9UPP1 1/20 0.38

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
SCHEMBL5208922 0.96 ALDH1A1 (0.50) MMP1MMP2MMP3MMP8CA12
SCHEMBL5208505 0.92 LMNA (0.54) MMP1MMP2MMP3MMP8CA12
SCHEMBL5207277 0.89 ALDH1A1 (0.55) MMP1MMP2MMP3MMP8CA12
SCHEMBL2046999 0.89 MMP1 (0.50) MMP1MMP2MMP3MMP8CA12
SCHEMBL6706470 0.87 MMP1 (0.56) MMP1MMP2MMP3MMP8CA12
SCHEMBL1815422 0.87 ALDH1A1 (0.58) MMP1MMP2MMP3MMP8CA12
SCHEMBL7557190 0.86 KDM5A (0.45) ALDH1A1KDM5AKDM4CPHF8
SCHEMBL6907090 0.86 KDM5A (0.45) ALDH1A1KDM5AKDM4CPHF8
SCHEMBL5208148 0.86 ALDH1A1 (0.52) MMP1MMP2MMP3MMP8CA12
SCHEMBL5203799 0.86 MMP1 (0.44) MMP1MMP2MMP3MMP8CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0958292-B1 4-(3-HETEROCYCLYL-1-BENZOYL)PYRAZOLES AND THEIR USE AS HERBICIDES BASF AG (DE) 2007-01-03 EP disclosed
US-6165944-A 4-(3-heterocyclyl-1-benzoyl) pyrazoles and their use as herbicides BASF AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
US-5658926-A ANTICOAGULANTS, ANTIHISTAMINES, ANTIARRHYTHMIC, CARTIOTONIC AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-19 US disclosed
EP-0516941-B1 Pyrazolopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1996-12-18 EP disclosed
US-5506239-A Carbostyril derivative and platelets aggregation inhibitory agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-04-09 US disclosed
EP-0569592-A1 CARBOSTYRIL DERIVATIVE AND PLATELET AGGLUTINATION INHIBITOR OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-11-18 EP disclosed
US-5234930-A Treating psychological, cardiovascular, urogenital and respiratory disorders; diabetes, asthmas, sudden infant death syndrome FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-08-10 US disclosed
EP-0516941-A1 Pyrazolopyridine compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-12-09 EP disclosed