SCHEMBL7092560

SCHEMBL7092560

CCCCCCCCOc1ccc(-c2cnc(-c3ccc(OC(=O)C(C)CC)cc3)nc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.53
▸ NPC1 O15118 8/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ LMNA P02545 4/20 0.49
▸ NFKB1 P19838 3/20 0.49
▸ NFKB2 Q00653 3/20 0.49
▸ RELA Q04206 3/20 0.49
▸ RAB9A P51151 5/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ MAPT P10636 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL10427215 1.00 RARB (0.53) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10427338 1.00 RARB (0.53) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10427538 1.00 RARB (0.53) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9239829 0.93 RARB (0.49) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10346221 0.93 RARB (0.49) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10574198 0.93 RARB (0.52) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10571268 0.93 RARB (0.52) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10574454 0.93 RARB (0.52) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10569975 0.93 RARB (0.52) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9233156 0.93 RARB (0.49) RARBNPC1SMN1; SMN2LMNANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739884-B1 Liquid crystal compound and liquid crystal composition containing the same SEMICONDUCTOR ENERGY LAB (JP) 2003-08-13 — — EP disclosed
US-5716542-A Liquid crystal compound and liquid crystal composition containing the same TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-02-10 — — US disclosed
EP-0739884-A2 Liquid crystal compound and liquid crystal composition containing the same Takasago International Corporation (JP) 1996-10-30 — — EP disclosed
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