SCHEMBL8604168

SCHEMBL8604168

C=CCc1ccc2cc(-c3ccc(C#CCCCC(C)F)cn3)ccc2c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL7557671 0.90 RAB9A (0.33) GRM5MAPTRAB9AL3MBTL1
SCHEMBL7552712 0.89 L3MBTL1 (0.33) GRM5MAPTRAB9AL3MBTL1
SCHEMBL7554730 0.89 NPC1 (0.33) RAB9A
SCHEMBL7559203 0.88 MAPT (0.31) MAPT
SCHEMBL7561510 0.87 HRH3 (0.35)
SCHEMBL7560671 0.86 RAB9A (0.36) MAPTRAB9AL3MBTL1
SCHEMBL8600121 0.86 SRC (0.39) GRM5L3MBTL1
SCHEMBL7549550 0.85 RAB9A (0.35) MAPTRAB9AL3MBTL1
SCHEMBL7555062 0.85 NPC1 (0.33) RAB9A
SCHEMBL8599770 0.84 ALDH1A1 (0.35) MAPT

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
EP-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed