SCHEMBL9302848

SCHEMBL9302848

OC(COc1ccccc1)CN1CCN(CCC(c2ccccc2)c2ccccc2)CC1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.74
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
KDM4E B2RXH2 3/20 0.68
CYP2D6 P10635 2/20 0.66
TSHR P16473 2/20 0.66
HIF1A Q16665 1/20 0.66
HTT P42858 1/20 0.62
ALDH1A1 P00352 3/20 0.62
GLA P06280 1/20 0.59
DRD4 P21917 4/20 0.59
DRD2 P14416 3/20 0.59
DRD3 P35462 3/20 0.59
USP2 O75604 1/20 0.56
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.55

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
SCHEMBL9303300 0.92 L3MBTL1 (0.70) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL9301892 0.91 KMT2A (0.67) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL4577971 0.87 L3MBTL1 (0.97) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL11240406 0.87 L3MBTL1 (0.97) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL3970369 0.87 L3MBTL1 (0.97) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL10379764 0.84 L3MBTL1 (0.62) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL9193205 0.84 L3MBTL1 (0.59) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL9302474 0.83 L3MBTL1 (0.64) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL6131254 0.83 KDM4E (0.85) L3MBTL1MEN1KMT2AKDM4ECYP2D6
SCHEMBL25010831 0.81 KDM4E (1.00) L3MBTL1MEN1KMT2AKDM4ECYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5342839-A Useful for therapy of oxygen deficiency diseases of the brain BASF AKTIENGESELLSCHAFT (DE) 1994-08-30 US disclosed
EP-0435902-A1 2-HYDROXY-3-PHENOXY-PROPYL-SUBSTITUTED PIPERAZINES AND HOMOPIPERAZINES, THEIR MANUFACTURE AND USE. BASF AG (DE) 1991-07-10 EP disclosed
WO-1990003371-A1 2-HYDROXY-3-PHENOXY-PROPYL-SUBSTITUTED PIPERAZINES AND HOMOPIPERAZINES, THEIR MANUFACTURE AND USE BASF AKTIENGESELLSCHAFT (DE) 1990-04-05 WO disclosed