SCHEMBL19998352

SCHEMBL19998352

CC(C)(C)OC(=O)N(C(=O)c1ccc(N)cc1)c1ccc(N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.37
MAOA P21397 2/20 0.37
LMNA P02545 2/20 0.37
CYP1A2 P05177 2/20 0.37
PHLPP2 Q6ZVD8 1/20 0.36
ELANE P08246 1/20 0.35
PARP10 Q53GL7 1/20 0.34
TSHR P16473 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CYP2D6 P10635 1/20 0.34
HTR3A P46098 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34

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
SCHEMBL6914487 0.89 CYP3A4 (0.39) CYP3A4MAOALMNACYP1A2PHLPP2
SCHEMBL25984799 0.81 ALDH1A1 (0.42) CYP3A4TSHRNR1H4NPSR1ALDH1A1
SCHEMBL1906868 0.80 ALDH1A1 (0.42) CYP3A4ELANETSHRCA12CA1
SCHEMBL8508900 0.79 CYP3A4 (0.53) CYP3A4CYP1A2TSHRCYP2D6NPSR1
SCHEMBL25347292 0.79 PARP10 (0.43) CYP3A4ELANEPARP10TSHRCA12
SCHEMBL22109511 0.79 CYP3A4 (0.36) CYP3A4MAOALMNACYP1A2PHLPP2
SCHEMBL19998349 0.78 MT-CO2 (0.46) CYP3A4MAOALMNACYP1A2PHLPP2
SCHEMBL19998347 0.78 MT-CO2 (0.46) CYP3A4MAOALMNACYP1A2PHLPP2
SCHEMBL1817649 0.77 PAX8 (0.49) CYP3A4LMNAPHLPP2TSHRNPSR1
SCHEMBL3256088 0.77 MAPT (0.44) ELANETSHRCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114806600-A Liquid crystal aligning agent, liquid crystal alignment film, method for producing same, and liquid crystal element JSR株式会社 2022-07-29 CN disclosed
CN-107338058-B Liquid crystal aligning agent, liquid crystal alignment film and method for producing same, liquid crystal element, polymer and compound JSR株式会社 2022-01-25 CN disclosed
WO-2019193854-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, LIQUID CRYSTAL ELEMENT, AND PRODUCTION METHOD FOR LIQUID CRYSTAL ELEMENT JSR株式会社 2019-10-10 WO disclosed
US-20180086978-A1 LIQUID CRYSTAL ELEMENT AND METHOD OF PRODUCING THE SAME JSR CORPORATION (JP) 2018-03-29 US disclosed