SCHEMBL8599509

SCHEMBL8599509

C=CCOc1cnc(-c2ccc3cc(C=CCCCC(C)F)ccc3c2)nc1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.35
ABL1 P00519 1/20 0.35
CASR P41180 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
SCHEMBL8672806 1.00 SRC (0.35) SRCABL1CASR
SCHEMBL7560609 0.92 SRC (0.40) SRCABL1CASR
SCHEMBL7560615 0.92 SRC (0.40) SRCABL1CASR
SCHEMBL7555055 0.91 NPC1 (0.34) SRCABL1
SCHEMBL7555050 0.91 NPC1 (0.34) SRCABL1
SCHEMBL7553881 0.90 NPC1 (0.34)
SCHEMBL7553876 0.90 NPC1 (0.34)
SCHEMBL7557406 0.88 SRC (0.37) SRCABL1CASR
SCHEMBL7557401 0.88 SRC (0.37) SRCABL1CASR
SCHEMBL8673410 0.87

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