SCHEMBL18718679

SCHEMBL18718679

CCCCCC1CCC(c2ccc(-c3ccc(OCC)c(F)c3F)c(F)c2)CO1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.37
ALOX5 P09917 1/20 0.34
FPR2 P25090 4/20 0.33
SLC6A2 P23975 3/20 0.32
SLC6A4 P31645 3/20 0.32
SLC6A3 Q01959 3/20 0.32
EPHX1 P07099 1/20 0.32
ALDH1A1 P00352 1/20 0.30
S1PR1 P21453 4/20 0.30
SGPL1 O95470 3/20 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
SCHEMBL18718693 0.99 KDM1A (0.36) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718727 0.99 KDM1A (0.36) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718661 0.97 KDM1A (0.37) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718681 0.95 ALOX5 (0.33) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718700 0.95 FPR2 (0.33) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718697 0.94 FPR2 (0.35) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718705 0.93 FPR2 (0.34) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718707 0.93 FPR2 (0.34) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL8943442 0.93 FPR2 (0.35) KDM1AALOX5FPR2SLC6A2SLC6A4
SCHEMBL18718682 0.93 FPR2 (0.33) KDM1AALOX5FPR2SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9909064-B2 Compound having tetrahydropyran ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2018-03-06 US disclosed
US-9909064-B2 Compound having tetrahydropyran ring, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2018-03-06 US disclosed
US-20170101582-A1 COMPOUND HAVING TETRAHYDROPYRAN RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2017-04-13 US disclosed
US-20170101582-A1 COMPOUND HAVING TETRAHYDROPYRAN RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2017-04-13 US disclosed