SCHEMBL18721403

SCHEMBL18721403

Cc1cc(C)c(F)c(I)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 9/20 0.39
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CYP2A6 P11509 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
SCHEMBL662008 0.80 RAPGEF4 (0.46) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL7025202 0.80 RAPGEF4 (0.46) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL2209559 0.79 RAPGEF4 (0.39) RAPGEF4
SCHEMBL13928793 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL16011578 0.75 NQO2 (0.34) ALDH1A1
SCHEMBL3007305 0.72 RAPGEF4 (0.39) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL8917677 0.72 RAPGEF4 (0.39) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL8268053 0.72 RAPGEF4 (0.52) RAPGEF4KDM4EALDH1A1LMNAGAA
SCHEMBL8760214 0.72 ACHE (0.48) ALDH1A1LMNACYP1A2
SCHEMBL19156967 0.70 RAPGEF4 (0.38) RAPGEF4KDM4EALDH1A1LMNAGAA

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-9617477-B2 Compound having four polymerizable groups, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2017-04-11 — — US disclosed
Send feedback