SCHEMBL17359388

SCHEMBL17359388

CCCc1ccc(C2CCC(COc3ccc(OCC)c(F)c3F)CC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 12/20 0.40
KDM1A O60341 2/20 0.36
SPHK2 Q9NRA0 7/20 0.36
PDE4B Q07343 1/20 0.34
ACACB O00763 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
SCHEMBL22277768 0.96 SPHK1 (0.38) SPHK1KDM1ASPHK2
SCHEMBL17359407 0.96 SPHK1 (0.38) SPHK1KDM1ASPHK2PDE4BACACB
SCHEMBL17357020 0.91 SPHK1 (0.38) SPHK1SPHK2PDE4BACACB
SCHEMBL9924896 0.90 SCN9A (0.37) SPHK1KDM1ASPHK2
SCHEMBL17359411 0.89 SPHK1 (0.36) SPHK1SPHK2PDE4BACACB
SCHEMBL22277766 0.88 SPHK1 (0.36) SPHK1SPHK2
SCHEMBL22277655 0.88 SPHK1 (0.49) SPHK1SPHK2
SCHEMBL9924782 0.88 SCN9A (0.35) SPHK1KDM1ASPHK2
SCHEMBL17357025 0.88 SPHK1 (0.36) SPHK1SPHK2PDE4BACACB
SCHEMBL9924945 0.88 SPHK1 (0.34) SPHK1KDM1ASPHK2CYP2C9

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-9475988-B2 Polymer stable alignment type liquid crystal composition and use thereof JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2016-10-25 US disclosed
US-20150368558-A1 POLYMER STABLE ALIGNMENT TYPE LIQUID CRYSTAL COMPOSITION AND USE THEREOF JIANGSU HECHENG DISPLAY TECHNOLOGY CO., LTD. (CN) 2015-12-24 US disclosed