SCHEMBL7902510

SCHEMBL7902510

CCC[C@H]1CC[C@H]([C@H]2CC[C@H](CCc3ccc(-c4ccc(CCCF)cc4)cc3)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.38
MAOA P21397 1/20 0.38
HRH3 Q9Y5N1 2/20 0.38
GPR84 Q9NQS5 1/20 0.36
RARB P10826 6/20 0.35
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
RARA P10276 1/20 0.33
MAPT P10636 1/20 0.33
MTOR P42345 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KCNH2 Q12809 1/20 0.33
TLR4 O00206 1/20 0.33
HTR2A P28223 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
SCHEMBL7902507 1.00 MAOB (0.38) MAOBMAOAHRH3GPR84RARB
SCHEMBL7902503 1.00 MAOB (0.38) MAOBMAOAHRH3GPR84RARB
SCHEMBL7912555 0.94 TSHR (0.38) MAOBMAOAHRH3GPR84RARB
SCHEMBL7912552 0.94 TSHR (0.38) MAOBMAOAHRH3GPR84RARB
SCHEMBL7912558 0.94 TSHR (0.38) MAOBMAOAHRH3GPR84RARB
SCHEMBL7912759 0.91 MAOB (0.40) MAOBMAOAHRH3HSD17B10ALDH1A1
SCHEMBL7912754 0.91 MAOB (0.40) MAOBMAOAHRH3HSD17B10ALDH1A1
SCHEMBL7912752 0.91 MAOB (0.40) MAOBMAOAHRH3HSD17B10ALDH1A1
SCHEMBL7912748 0.91 MAOB (0.40) MAOBMAOAHRH3HSD17B10ALDH1A1
SCHEMBL7915945 0.90 HSD17B10 (0.41) MAOBMAOAHRH3GPR84RARB

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