SCHEMBL17422012

SCHEMBL17422012

c1ccc2cc(Nc3ccc(-c4ccc(Nc5cccc6ccccc56)cc4)cc3)ccc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
CYP3A4 P08684 3/20 0.61
HSD17B10 Q99714 3/20 0.61
HPGD P15428 2/20 0.61
CDC25B P30305 2/20 0.61
TP53 P04637 1/20 0.61
ALOX15 P16050 1/20 0.61
TSHR P16473 1/20 0.61
ATM Q13315 1/20 0.61
RAB9A P51151 1/20 0.58
FADS1 O60427 1/20 0.55
MAPK14 Q16539 2/20 0.48
MAPT P10636 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 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
SCHEMBL13367390 0.92 ALDH1A1 (0.62) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL30041543 0.92 ALDH1A1 (0.62) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL20550403 0.92 ALDH1A1 (0.73) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL29365372 0.92 ALDH1A1 (0.66) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL557025 0.92 ALDH1A1 (0.66) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL12476447 0.89 ALDH1A1 (0.59) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL74528 0.88 HSD17B10 (0.77) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL29521400 0.88 HSD17B10 (0.77) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL22892568 0.88 ALDH1A1 (0.50) ALDH1A1CYP3A4HSD17B10HPGDCDC25B
SCHEMBL4884667 0.86 ALDH1A1 (0.81) ALDH1A1CYP3A4HSD17B10HPGDCDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106537629-B Charge-transporting varnish 日产化学工业株式会社 2019-03-29 CN claimed
EP-3168888-A1 CHARGE-TRANSPORTING VARNISH Nissan Chemical Industries, Ltd. (JP) 2017-05-17 EP claimed
CN-106537629-A Charge-transporting varnish 日产化学工业株式会社 2017-03-22 CN claimed
CN-106537629-B Charge-transporting varnish 日产化学工业株式会社 2019-03-29 CN disclosed
CN-106537629-B Charge-transporting varnish 日产化学工业株式会社 2019-03-29 CN disclosed
US-20170186951-A1 CHARGE-TRANSPORTING VARNISH NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-06-29 US disclosed
US-20170186951-A1 CHARGE-TRANSPORTING VARNISH NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2017-06-29 US disclosed
EP-3168888-A1 CHARGE-TRANSPORTING VARNISH Nissan Chemical Industries, Ltd. (JP) 2017-05-17 EP disclosed
EP-3168888-A1 CHARGE-TRANSPORTING VARNISH Nissan Chemical Industries, Ltd. (JP) 2017-05-17 EP disclosed
CN-106537629-A Charge-transporting varnish 日产化学工业株式会社 2017-03-22 CN disclosed
CN-106537629-A Charge-transporting varnish 日产化学工业株式会社 2017-03-22 CN disclosed
WO-2016006673-A1 CHARGE-TRANSPORTING VARNISH 日産化学工業株式会社 2016-01-14 WO disclosed