SCHEMBL11942586

SCHEMBL11942586

CCCc1ccc(C2CC=C(c3ccc(-c4ccc(OC)c(F)c4F)c(F)c3F)CC2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.36
▸ CTSS P25774 1/20 0.36
▸ CTSK P43235 1/20 0.36
▸ FPR2 P25090 3/20 0.32
▸ CCNT1 O60563 1/20 0.31
▸ CDK9 P50750 1/20 0.31
▸ ELANE P08246 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
SCHEMBL11933139 0.92 CTSL (0.39) CTSLCTSSCTSKFPR2
SCHEMBL11933129 0.92 CTSL (0.39) CTSLCTSSCTSKFPR2
SCHEMBL12196649 0.91 CTSL (0.37) CTSLCTSSCTSK
SCHEMBL15381787 0.90 CTSL (0.36) CTSLCTSSCTSK
SCHEMBL12196630 0.89 CTSL (0.36) CTSLCTSSCTSK
SCHEMBL12196599 0.89 CTSL (0.36) CTSLCTSSCTSK
SCHEMBL15381793 0.87 CTSL (0.35) CTSLCTSSCTSK
SCHEMBL15381707 0.87 CTSL (0.35) CTSLCTSSCTSK
SCHEMBL12511916 0.86 — —
SCHEMBL15381672 0.86 CTSL (0.32) CTSLCTSSCTSK

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
EP-2479162-B1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2016-10-26 — — EP disclosed
EP-2479162-A1 LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC Corporation (JP) 2012-07-25 — — EP disclosed
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