SCHEMBL7912561

SCHEMBL7912561

COc1ccc(-c2ccc(C3CCC([C@H]4CC[C@H](CCCCCCF)CC4)CC3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.39
DGAT1 O75907 1/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MMP2 P08253 2/20 0.35
MMP13 P45452 2/20 0.35
MMP9 P14780 1/20 0.35
MMP8 P22894 1/20 0.35
ESR2 Q92731 1/20 0.35
MAPT P10636 2/20 0.34
HTR2C P28335 1/20 0.33

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
SCHEMBL7912570 1.00 DRD2 (0.39) DRD2DGAT1SLC6A2SLC6A4SLC6A3
SCHEMBL7912574 1.00 DRD2 (0.39) DRD2DGAT1SLC6A2SLC6A4SLC6A3
SCHEMBL19722086 0.91 DRD2 (0.43) DRD2DGAT1SLC6A2SLC6A4SLC6A3
SCHEMBL10763927 0.84 DRD2 (0.49) DRD2ALDH1A1MEN1KMT2AMAPK1
SCHEMBL10659015 0.84 DRD2 (0.49) DRD2DGAT1ALDH1A1SMN1; SMN2MEN1
SCHEMBL11286368 0.84 DRD2 (0.49) DRD2DGAT1ALDH1A1SMN1; SMN2MEN1
SCHEMBL11194222 0.84 DRD2 (0.49) DRD2ALDH1A1MEN1KMT2AMAPK1
SCHEMBL10763920 0.84 DRD2 (0.49) DRD2ALDH1A1MEN1KMT2AMAPK1
SCHEMBL11283709 0.84 DRD2 (0.49) DRD2DGAT1ALDH1A1SMN1; SMN2MEN1
SCHEMBL11287630 0.84 DRD2 (0.49) DRD2DGAT1ALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6174456-B1 STABILITY, LOW VISCOSITY AND HIGH TRANSITION TEMPERATURE OF THE ISOTROPIC PHASE CHISSO CORPORATION (JP) 2001-01-16 US disclosed
EP-0857708-A1 LIQUID CRYSTAL COMPOUNDS HAVING SUBSTITUTED ALKYL GROUPS, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1998-08-12 EP disclosed