SCHEMBL16248271

SCHEMBL16248271

CCCCCc1ccc(C(=O)Oc2ccc(N=Nc3ccc(N=Nc4ccc(CCCC)cc4)c4ccccc34)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ PRSS1 P07477 4/20 0.46
▸ ACR P10323 2/20 0.46
▸ THRB P10828 2/20 0.45
▸ THRA P10827 1/20 0.44
▸ NPC1 O15118 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ F2 P00734 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ PPARA Q07869 2/20 0.40
▸ PPARG P37231 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL15810560 1.00 MAPT (0.47) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL17696399 0.94 PRSS1 (0.46) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL21400315 0.87 THRB (0.56) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL20102623 0.86 PRSS1 (0.56) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL20102626 0.84 PRSS1 (0.53) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL20111349 0.84 RARB (0.58) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL9650045 0.83 PRSS1 (0.55) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL9650043 0.83 PRSS1 (0.55) MAPTSMN1; SMN2PRSS1ACRTHRB
SCHEMBL5666123 0.82 THRB (0.63) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL5665862 0.82 THRB (0.63) MAPTSMN1; SMN2THRBTHRANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820932-B2 Polymerisable liquid crystal material and polymerised liquid crystal film MERCK PATENT GMBH (DE) 2023-11-21 — — US disclosed
US-10982146-B2 Liquid crystal composition, liquid crystal element, and use of liquid crystal composition in liquid crystal element JNC CORPORATION (JP) 2021-04-20 — — US disclosed
US-20190225886-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL ELEMENT, AND USE OF LIQUID CRYSTAL COMPOSITION IN LIQUID CRYSTAL ELEMENT JNC CORPORATION (JP) 2019-07-25 — — US disclosed
US-20170253801-A1 LIQUID-CRYSTAL MEDIA AND LIGHT MODULATION ELEMENT MERCK PATENT GMBH (DE) 2017-09-07 — — US disclosed
WO-2017067630-A1 LIGHT MODULATION ELEMENT MERCK PATENT GMBH (DE) 2017-04-27 — — WO disclosed
WO-2014183825-A1 LIQUID CRYSTALLINE MEDIUM AND LIQUID CRYSTAL DEVICE MERCK PATENT GMBH (DE) 2014-11-20 — — WO disclosed
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