SCHEMBL942098

SCHEMBL942098

CCOC(=O)C(C(=O)OCC)(c1ccc(N)c(Cl)c1)c1ccc(N)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.40
TSHR P16473 4/20 0.40
CYP1A2 P05177 2/20 0.40
ABCB11 O95342 1/20 0.40
HTR2A P28223 1/20 0.40
PMP22 Q01453 1/20 0.40
PPARA Q07869 1/20 0.40
HPGD P15428 2/20 0.39
CNR2 P34972 2/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 2/20 0.37
THRB P10828 2/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
RECQL P46063 1/20 0.37
MAOA P21397 1/20 0.36

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
SCHEMBL11152774 0.87 CYP3A4 (0.42) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL940605 0.77 LMNA (0.55) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL943436 0.76 CYP3A4 (0.36) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL9304801 0.73 TSHR (0.45) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL868005 0.73 CYP1A2 (0.59) CYP3A4CYP1A2LMNAALDH1A1HSD17B10
SCHEMBL22992388 0.72 CNR2 (0.48) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL30546502 0.72 CNR2 (0.48) CYP3A4TSHRCYP1A2ABCB11HTR2A
SCHEMBL30730276 0.72 CNR2 (0.54) CYP3A4TSHRCYP1A2ABCB11HTR2A
Hydrochloric Acid SCHEMBL27783042 0.72 CYP1A2 (0.57) CYP3A4CYP1A2LMNAALDH1A1HSD17B10
SCHEMBL9612065 0.72 CNR1 (0.48) CYP3A4TSHRHPGDCNR2MAPK1

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