SCHEMBL7732647

SCHEMBL7732647

CCCCCC1CCC(C2CCC(c3ccccc3)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.45
CYP2C9 P11712 2/20 0.43
MAPT P10636 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 3/20 0.41
LMNA P02545 2/20 0.41
MAPK1 P28482 2/20 0.41
SPHK1 Q9NYA1 2/20 0.41
GAA P10253 3/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
CYP2C19 P33261 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ESR2 Q92731 1/20 0.39

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
SCHEMBL8138102 1.00 DRD2 (0.45) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL8138097 1.00 DRD2 (0.45) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10768148 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10767465 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10764777 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10762925 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10768144 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10763591 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10764774 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A
SCHEMBL10762922 0.98 DRD2 (0.44) DRD2CYP2C9MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476266-B1 Diamino compound and production process for the same CHISSO CORPORATION (JP) 2002-11-05 US disclosed
US-6074708-A Photoinitiator photopolymerizable resin composition, polymer and liquid crystal display device SHARP KABUSHIKI KAISHA (JP) 2000-06-13 US disclosed
US-4970022-A ISOTHIOCYANATES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-11-13 US disclosed
EP-0250505-B1 LIQUID CRYSTAL ISOTHIOCYANATE DERIVATIVES MERCK PATENT GmbH (DE) 1990-07-04 EP disclosed
EP-0250505-A1 LIQUID CRYSTAL ISOTHIOCYANATE DERIVATIVES. MERCK PATENT GMBH (DE) 1988-01-07 EP disclosed
EP-0094487-B1 HYDROTERPHENYLS, THEIR PREPARATION AND THEIR USE IN DIELECTRIC LIQUID CRYSTAL MATERIAL MERCK PATENT GmbH (DE) 1987-09-09 EP disclosed
WO-1987003870-A1 LIQUID CRYSTAL ISOTHIOCYANATE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-07-02 WO disclosed
US-4620938-A Hydroterphenyls MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-11-04 US disclosed
US-4422951-A Liquid crystal benzene derivatives CHISSO CORPORATION (JP) 1983-12-27 US disclosed
EP-0094487-A1 Hydroterphenyls, their preparation and their use in dielectric liquid crystal material MERCK PATENT GmbH (DE) 1983-11-23 EP disclosed
EP-0062470-A1 Liquid crystal benzene derivatives Chisso Corporation (JP) 1982-10-13 EP disclosed