SCHEMBL19985344

SCHEMBL19985344

CCCCCCCC1CCC(c2ccc(-c3ccc(OC)c(F)c3F)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
SPHK1 Q9NYA1 6/20 0.36
CYP2C9 P11712 1/20 0.36
DGAT1 O75907 1/20 0.35
SOAT1 P35610 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
ESR2 Q92731 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
FPR2 P25090 3/20 0.34
DPP4 P27487 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
SCHEMBL19985337 1.00 MAPT (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL19985352 1.00 MAPT (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL17584846 0.99 CYP2C9 (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL17584845 0.95 CYP2C9 (0.37) MAPTSPHK1CYP2C9DGAT1SOAT1
SCHEMBL8933186 0.93 FPR2 (0.35) MAPTGAACYP2C9CNR1CNR2
SCHEMBL8933024 0.91 FPR2 (0.36) MAPTGAACYP2C9CNR1CNR2
SCHEMBL19985334 0.91 MAPT (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL19985354 0.91 MAPT (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL19985348 0.91 MAPT (0.36) MAPTGAASPHK1CYP2C9DGAT1
SCHEMBL17584849 0.91 CYP2C9 (0.44) MAPTCYP2C9DGAT1SOAT1ESR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 US disclosed