SCHEMBL942142

SCHEMBL942142

O=C(c1ccc(N=C=S)c(F)c1)c1ccc(N=C=S)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
HSD17B14 Q9BPX1 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 2/20 0.33
RAB9A P51151 2/20 0.33
TSHR P16473 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
ALOX15 P16050 1/20 0.33
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ACHE P22303 1/20 0.33
HSD17B1 P14061 3/20 0.33
HSD17B2 P37059 3/20 0.33
CTSL P07711 2/20 0.32
CTSK P43235 1/20 0.32
GAA P10253 1/20 0.32
HDAC1 Q13547 2/20 0.32

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
SCHEMBL28559554 0.83 TDP1 (0.34) SMN1; SMN2HPGDMAPK1TSHRALOX15
SCHEMBL29874662 0.79 SMN1; SMN2 (0.44) CES2CES1SMN1; SMN2HPGDMAPK1
SCHEMBL483530 0.79 SMN1; SMN2 (0.44) CES2CES1SMN1; SMN2HPGDMAPK1
SCHEMBL28371956 0.76 ESR1 (0.37) HPGDALOX15ALDH1A1CYP1A2CYP3A4
SCHEMBL29564714 0.75 ALDH1A1 (0.38) CES2CES1HPGDALOX15LMNA
SCHEMBL156589 0.75 ALDH1A1 (0.38) CES2CES1HPGDALOX15LMNA
SCHEMBL9220168 0.72 MAOB (0.40) CES2CES1HPGDRAB9ANPC1
SCHEMBL990169 0.72 ABCB11 (0.33) HPGDALOX15ALDH1A1CYP1A2CYP3A4
SCHEMBL348654 0.72 ALDH1A1 (0.33) HPGDRAB9ANPC1ALOX15LMNA
SCHEMBL1095141 0.72 NAAA (0.39) SMN1; SMN2HPGDRAB9ANPC1TP53

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