SCHEMBL8553887

SCHEMBL8553887

CCCCCCCC1CCc2ccccc2N1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.52
PRKCD Q05655 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
DRD2 P14416 2/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
AR P10275 1/20 0.35

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
SCHEMBL29593079 1.00 MTNR1A (0.52) MTNR1APRKCDALDH1A1MEN1KMT2A
SCHEMBL22977707 1.00 MTNR1A (0.52) MTNR1APRKCDALDH1A1MEN1KMT2A
SCHEMBL4128722 0.98 MTNR1A (0.53) MTNR1APRKCDALDH1A1MEN1KMT2A
SCHEMBL4045997 0.94 MTNR1A (0.55) MTNR1AALDH1A1MEN1KMT2ABRD4
SCHEMBL4138599 0.87 MTNR1A (0.57) MTNR1ABRD4CREBBPDRD2AR
SCHEMBL18668694 0.85 MTNR1A (0.46) MTNR1ACREBBP
SCHEMBL23010557 0.84 ALDH1A1 (0.47) MTNR1APRKCDALDH1A1MEN1KMT2A
SCHEMBL28923894 0.84 ALDH1A1 (0.47) MTNR1APRKCDALDH1A1MEN1KMT2A
SCHEMBL7951734 0.84 MTNR1A (0.55) MTNR1ABRD4CREBBP
SCHEMBL13610205 0.83 MTNR1A (0.48) MTNR1AALDH1A1BRD4CREBBPCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0529452-B1 1,7-Condensed 3-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them SOLVAY PHARM GMBH (DE) 1998-11-11 EP disclosed
US-5324725-A Antiinflammatory agent, antiallergen KALI-CHEMIE PHARMA GMBH (DE) 1994-06-28 US disclosed
CN-1069732-A 1, the 2-that 7-a pair of horses going side by side is closed (piperazine alkyl) indole derivatives and preparation method and intermediate product and the medicament that contains these compounds KALI CHEMIE PHARMA GMBH (DE) 1993-03-10 CN disclosed
EP-0529452-A2 1,7-Condensed 2-(piperazinoalkyl)indol derivatives, process and intermediates for their preparation and pharmaceutical compositions containing them Kali-Chemie Pharma GmbH (DE) 1993-03-03 EP disclosed