SCHEMBL20102623

SCHEMBL20102623

CCCCCc1ccc(C(=O)Oc2ccc(N=Nc3ccc(CCC)cc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS1 P07477 6/20 0.56
▸ ACR P10323 3/20 0.56
▸ MAPT P10636 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ THRB P10828 5/20 0.53
▸ THRA P10827 1/20 0.51
▸ F2 P00734 2/20 0.50
▸ PRSS2 P07478 2/20 0.50
▸ PRSS3 P35030 2/20 0.50
▸ TMPRSS2 O15393 1/20 0.48
▸ KLK1 P06870 1/20 0.48
▸ NPC1 O15118 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ PLA2G1B P04054 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ ATG4B Q9Y4P1 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47

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
SCHEMBL21400315 0.96 THRB (0.56) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL20111349 0.92 RARB (0.58) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL20102626 0.92 PRSS1 (0.53) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL9842583 0.92 THRB (0.61) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL3612308 0.92 THRB (0.61) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL9650043 0.91 PRSS1 (0.55) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL9650045 0.91 PRSS1 (0.55) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL8377166 0.90 THRB (0.61) MAPTSMN1; SMN2THRBTHRANPC1
SCHEMBL20111345 0.90 MAPT (0.50) PRSS1ACRMAPTSMN1; SMN2THRB
SCHEMBL7079660 0.89 THRB (0.65) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180120650-A1 LIQUID CRYSTAL MATERIAL, LIQUID CRYSTAL DISPLAY PANEL AND MANUFACTURE METHOD OF LIQUID CRYSTAL DISPLAY PANEL SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2018-05-03 — — US disclosed
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