SCHEMBL28335010

SCHEMBL28335010

NC(=O)NCCc1ccccc1N

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 7/20 0.63
MTNR1B P49286 4/20 0.47
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
NOTUM Q6P988 1/20 0.42
RCE1 Q9Y256 1/20 0.41
HIF1A Q16665 1/20 0.40
BCAT2 O15382 1/20 0.40
PTGS2 P35354 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CNR1 P21554 1/20 0.39
FDPS P14324 1/20 0.39

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
SCHEMBL15939458 0.87 MTNR1A (0.49) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL4598193 0.85 MTNR1A (0.46) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL28029765 0.85 HPGD (0.54) MTNR1AKDM4EALDH1A1HPGDRCE1
SCHEMBL3072431 0.84 MTNR1A (0.61) MTNR1AMTNR1BKDM4E
SCHEMBL28161798 0.81 HIF1A (0.57) MTNR1AMTNR1BALDH1A1HPGDHIF1A
SCHEMBL5913061 0.80 MTNR1A (0.49) MTNR1AMTNR1BALDH1A1CNR1
SCHEMBL5511489 0.77 MTNR1A (1.00) MTNR1AMTNR1BKDM4E
SCHEMBL19031451 0.76 ALDH1A1 (0.40) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL14893135 0.76 MTNR1A (0.74) MTNR1AMTNR1BALDH1A1HPGDCNR1
SCHEMBL31250995 0.76 NQO2 (0.56) HPGD

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
CN-111448510-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, and method for producing liquid crystal element JSR株式会社 2020-07-24 CN disclosed
CN-111433665-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, and method for producing liquid crystal element JSR株式会社 2020-07-17 CN disclosed
CN-105733610-B Composition containing polyamic acid polymer, liquid crystal aligning agent, liquid crystal aligning film and liquid crystal display element JSR株式会社 2019-12-17 CN disclosed
CN-103666487-B Crystal aligning agent, liquid crystal orienting film and liquid crystal display cells JSR株式会社 2016-08-24 CN disclosed
CN-105733610-A COMPOSITION CONTAINING POLYAMIDE ACID POLYMER, LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY DEVICE JSR株式会社 2016-07-06 CN disclosed
CN-104861990-A Liquid crystal aligning agent, liquid crystal aligning film and liquid crystal display element JSR CORP 2015-08-26 CN disclosed