SCHEMBL19999599

SCHEMBL19999599

CCCCCCCc1cc(F)c2c(F)c(-c3ccc(-c4cc(F)c(C#Cc5cc(F)c(-c6cc(F)c(F)c(F)c6)c(F)c5)c(CC)c4)cc3)c(F)cc2c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.35
RARA P10276 1/20 0.35
RARG P13631 1/20 0.35
TSHR P16473 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL19999504 0.98 RARB (0.36) RARBRARARARGTSHRHSD17B10
SCHEMBL19999469 0.88 RARB (0.33) RARB
SCHEMBL19999641 0.87 ESR1 (0.31)
SCHEMBL20004918 0.86 ESR1 (0.33)
SCHEMBL20004897 0.85
SCHEMBL20004782 0.82 ESR1 (0.31)
SCHEMBL20006944 0.82 ESR1 (0.30)
SCHEMBL19999564 0.81 RARB (0.32) RARB
SCHEMBL14526125 0.80
SCHEMBL20006755 0.80 ESR1 (0.31)

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-20180086979-A1 LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2018-03-29 US disclosed