SCHEMBL7817092

SCHEMBL7817092

O=C1CCCC2=C1C(c1ccc(Cl)cc1)C1=C(CCCC1=O)N2

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR174 Q9BXC1 5/20 0.70
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
LMNA P02545 1/20 0.58
TSHR P16473 1/20 0.58
KMT2A Q03164 1/20 0.58
ABCC9 O60706 13/20 0.53
ABCC8 Q09428 13/20 0.53
KCNJ11 Q14654 13/20 0.53
KCNJ8 Q15842 13/20 0.53

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
SCHEMBL7832437 0.90 GPR174 (0.59) GPR174KDM4EMEN1LMNATSHR
SCHEMBL7820326 0.84 ALDH1A1 (0.67) GPR174KDM4EMEN1KMT2AABCC9
SCHEMBL7817859 0.84 ALDH1A1 (0.63) GPR174KDM4EMEN1KMT2AABCC9
SCHEMBL7817258 0.83 GPR174 (0.72) GPR174MEN1KMT2AABCC9ABCC8
SCHEMBL1002731 0.83 ABCC9 (0.73) GPR174KDM4EKMT2AABCC9ABCC8
SCHEMBL22388478 0.83 GPR174 (1.00) GPR174MEN1KMT2A
SCHEMBL15435890 0.83 GPR174 (0.91) GPR174MEN1KMT2A
SCHEMBL7833345 0.83 ABCC9 (0.75) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7836312 0.82 ABCC9 (0.66) GPR174MEN1KMT2AABCC9ABCC8
SCHEMBL15450429 0.78 GPR174 (0.70) GPR174MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265127-B1 1, 4-dihydrophyridine charge control agents for electrostatographic toners and developers EASTMAN KODAK COMPANY 2001-07-24 US disclosed
EP-1109070-A2 1,4-Dihydropyridine charge control agents for electrostatographic toners and developers EASTMAN KODAK COMPANY (US) 2001-06-20 EP disclosed
EP-0665834-B1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ASTRAZENECA AB (SE) 2001-05-30 EP disclosed
US-5622964-A ADMINISTERING 4,6,7,8-TETRAHYDRO-5(1H)-QUINOLONE DERIVATIVE TO TREAT ASTHMA IN MAMMALS ZENECA LIMITED (GB) 1997-04-22 US disclosed
US-5455253-A For urinary incontinence ZENECA LIMITED (GB) 1995-10-03 US disclosed
EP-0665834-A1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ZENECA LIMITED (GB) 1995-08-09 EP disclosed
WO-1994008966-A1 QUINOLONE AND ACRIDINONE DERIVATIVES FOR THE TREATMENT OF URINARY INCONTINENCE ZENECA LIMITED (GB) 1994-04-28 WO disclosed