SCHEMBL940978

SCHEMBL940978

O=C=Nc1ccc(C(=O)c2ccc(N=C=O)c(Cl)c2)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 4/20 0.46
TDP1 Q9NUW8 2/20 0.40
MAPK1 P28482 2/20 0.40
VCAM1 P19320 2/20 0.40
TSHR P16473 1/20 0.38
CYP3A4 P08684 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
TRPA1 O75762 1/20 0.34
HSD17B1 P14061 3/20 0.33
HSD17B2 P37059 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL28023527 0.82 CYP3A4 (0.39) SRD5A2TDP1MAPK1TSHRCYP3A4
SCHEMBL1093397 0.82 ALDH1A1 (0.48) TDP1TSHRCYP3A4ALDH1A1HPGD
SCHEMBL11198992 0.79 SIRT1 (0.40) TDP1CYP3A4ALDH1A1HPGDPOLB
SCHEMBL11188602 0.78 CYP3A4 (0.46) SRD5A2TDP1MAPK1TSHRCYP3A4
SCHEMBL11197704 0.78 ALDH1A1 (0.44) SRD5A2TDP1MAPK1TSHRCYP3A4
SCHEMBL14540599 0.77 HSD17B10 (0.46) TDP1MAPK1CYP3A4ALDH1A1HPGD
SCHEMBL11193791 0.76 TDP1 (0.47) SRD5A2TDP1CYP3A4ALDH1A1HPGD
SCHEMBL29565739 0.76 CYP3A4 (0.53) TDP1MAPK1TSHRCYP3A4ALDH1A1
SCHEMBL29862788 0.76 TDP1 (0.45) TDP1MAPK1TSHRCYP3A4ALDH1A1
SCHEMBL227614 0.76 TDP1 (0.45) TDP1MAPK1TSHRCYP3A4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8840559-B2 Organic piezoelectric material, ultrasonic oscillator using the material, method for manufacturing the ultrasonic oscillator, ultrasonic probe, and ultrasonic medical diagnostic imaging device KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2014-09-23 US disclosed
US-20110021916-A1 ORGANIC PIEZOELECTRIC MATERIAL, ULTRASONIC OSCILLATOR USING THE MATERIAL, METHOD FOR MANUFACTURING THE ULTRASONIC OSCILLATOR, ULTRASONIC PROBE, AND ULTRASONIC MEDICAL DIAGNOSTIC IMAGING DEVICE KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-01-27 US disclosed
US-20110021917-A1 ORGANIC PIEZOELECTRIC MATERIAL FILM, METHOD FOR PRODUCTION OF THE SAME, METHOD FOR PRODUCTION OF ULTRASONIC OSCILLATOR USING THE SAME, AND ULTRASONIC MEDICAL IMAGING INSTRUMENT KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-01-27 US disclosed
US-20110004102-A1 ORGANIC PIEZOELECTRIC MATERIAL, ULTRASONIC OSCILLATOR USING THE SAME, METHOD FOR PRODUCING THE ULTRASONIC OSCILLATOR, ULTRASONIC PROBE AND ULTRASONIC MEDICAL DIAGNOSTIC IMAGING DEVICE KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-01-06 US disclosed
US-4421905-A METAL ACETYLACETONATE AS POLYMERIZATION CATALYSTS PLASTICS ENGINEERING COMPANY (US) 1983-12-20 US disclosed