SCHEMBL10366646

SCHEMBL10366646

OCCN1CCN(c2ccc(Cl)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.61
GAA P10253 2/20 0.61
ALDH1A1 P00352 2/20 0.58
HPGD P15428 1/20 0.58
HSD17B10 Q99714 1/20 0.58
SIGMAR1 Q99720 3/20 0.58
HTR1A P08908 5/20 0.57
DRD4 P21917 3/20 0.57
HTR7 P34969 1/20 0.56
DRD2 P14416 5/20 0.55
DRD3 P35462 3/20 0.55
HTR2A P28223 2/20 0.55
TMEM97 Q5BJF2 2/20 0.55
CACNA1G O43497 1/20 0.55
MAPT P10636 2/20 0.54
GFER P55789 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
DRD1 P21728 1/20 0.54
DRD5 P21918 1/20 0.54

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
SCHEMBL9393977 0.89 KDM4E (0.67) KDM4EGAASIGMAR1HTR1ADRD4
SCHEMBL11402886 0.88 KDM4E (0.69) KDM4EGAASIGMAR1HTR1ADRD4
SCHEMBL18754269 0.85 KDM4E (0.75) KDM4EGAASIGMAR1HTR1ADRD4
SCHEMBL14067276 0.85 DRD4 (0.61) KDM4EGAAALDH1A1SIGMAR1HTR1A
SCHEMBL13079491 0.83 KDM4E (0.78) KDM4EGAASIGMAR1HTR1ADRD4
SCHEMBL8102656 0.83 KDM4E (0.63) KDM4EGAAALDH1A1SIGMAR1HTR1A
SCHEMBL4400393 0.81 KDM4E (0.61) KDM4EGAAALDH1A1HSD17B10SIGMAR1
SCHEMBL2093634 0.81 KDM4E (0.61) KDM4EGAAALDH1A1SIGMAR1HTR1A
SCHEMBL82832 0.81 MAPT (0.61) SIGMAR1HTR1AHTR7DRD2MAPT
SCHEMBL6150880 0.81 MAPT (0.62) KDM4EGAAALDH1A1HSD17B10SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0094159-B1 DIHYDROPYRIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1990-03-14 EP disclosed
US-4892875-A HYPOTENSIVE, RENAL VASODILATION TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-01-09 US disclosed
EP-0094159-A1 Dihydropyridine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-11-16 EP disclosed
US-4147790-A (4-Phenyl-piperazino alkyl)-3-benzoyl-benzene alkanoates ROUSSEL UCLAF (FR) 1979-04-03 US disclosed
US-4017623-A Esters of 2-[(4-quinolyl)amino]-benzoic acids in analgesic and anti-inflammatory compositions SYNTHELABO (FR) 1977-04-12 US disclosed
US-3935229-A ANALGESIC, ANTIINFLAMMATORY SYNTHELABO (FR) 1976-01-27 US disclosed