SCHEMBL7912892

SCHEMBL7912892

CCCCCc1ccc(-c2ccc(CCC3CCC(C4CCC(CCCF)CC4)CC3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.42
RARB P10826 7/20 0.41
HSD17B10 Q99714 2/20 0.41
TSHR P16473 1/20 0.41
HTR2A P28223 1/20 0.41
RARA P10276 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
MTOR P42345 1/20 0.40
KMT2A Q03164 1/20 0.40
SPHK1 Q9NYA1 5/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
RARG P13631 1/20 0.39
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37

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
SCHEMBL7912895 1.00 HRH3 (0.42) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912885 1.00 HRH3 (0.42) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912587 0.95 HSD17B10 (0.43) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912592 0.95 HSD17B10 (0.43) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912594 0.95 HSD17B10 (0.43) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7911054 0.92 RARB (0.39) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7911059 0.92 RARB (0.39) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7911047 0.92 RARB (0.39) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912882 0.90 MAOA (0.37) HRH3RARBHSD17B10TSHRHTR2A
SCHEMBL7912883 0.90 MAOA (0.37) HRH3RARBHSD17B10TSHRHTR2A

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