SCHEMBL940457

SCHEMBL940457

NC1=CC=C2C(=C(Cc3ccccc3)c3cc(N)ccc32)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
PTPRC P08575 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
APAF1 O14727 1/20 0.40
TDP2 O95551 1/20 0.40
NSD2 O96028 1/20 0.40
LMNA P02545 1/20 0.40
PLA2G1B P04054 1/20 0.40
POLB P06746 1/20 0.40
CTSL P07711 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL941733 0.73 ALDH1A1 (0.41) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
SCHEMBL29249557 0.64 MAPK1 (0.56) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
SCHEMBL2146135 0.63 PTPN1 (0.53) ALDH1A1TDP1CYP3A4TSHRMEN1
SCHEMBL29217220 0.63 CYP1A2 (0.41) ALDH1A1RAB9AMAPK1PTPRCMEN1
SCHEMBL10703351 0.63 HTR2A (0.48) ALDH1A1TDP1CYP3A4TSHRGAA
Benzene SCHEMBL28832927 0.62 NPC1 (0.95) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
SCHEMBL1032694 0.60 NPC1 (0.39) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
SCHEMBL9019022 0.60 NPC1 (0.39) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
Anthraquinone SCHEMBL23363689 0.60 NPC1 (1.00) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1
SCHEMBL40960 0.60 NPC1 (1.00) NPC1ALDH1A1RAB9ASMN1; SMN2MAPK1

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-20110021918-A1 ORGANIC PIEZOELECTRIC MATERIAL FILM, METHOD FOR PRODUCTION OF ORGANIC PIEZOELECTRIC MATERIAL FILM, METHOD FOR PRODUCTION OF ULTRASONIC OSCILLATOR, AND ULTRASONIC MEDICAL IMAGING INSTRUMENT 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