SCHEMBL12424925

SCHEMBL12424925

CN(C)c1ccc(C2=C3C(=O)NC(c4ccc(N(C)C)cc4C(F)(F)F)=C3C(=O)N2)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 3/20 0.49
JAK2 O60674 1/20 0.49
JAK1 P23458 1/20 0.49
AR P10275 5/20 0.46
ALDH1A1 P00352 2/20 0.41
PDK2 Q15119 1/20 0.38
CRHR1 P34998 3/20 0.36
PDGFRB P09619 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APP P05067 1/20 0.33
MAPT P10636 1/20 0.33
CES1 P23141 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
SCHEMBL12425005 0.82 JAK3 (0.53) JAK3JAK2JAK1ARALDH1A1
SCHEMBL13990192 0.79 TSHR (0.48) JAK3JAK2JAK1ARALDH1A1
SCHEMBL12424878 0.77 ALDH1A1 (0.44) JAK3JAK2JAK1ARALDH1A1
SCHEMBL12424904 0.73 STK10 (0.51) ALDH1A1HPGDCES1
SCHEMBL18000078 0.71 CRHR1 (0.43) JAK3JAK2JAK1ARALDH1A1
SCHEMBL12425012 0.70 ALDH1A1 (0.37) JAK3JAK2JAK1ALDH1A1PDGFRB
SCHEMBL5892113 0.69 ALDH1A1 (0.44) ALDH1A1PDGFRBHPGDSMN1; SMN2HSD17B10
SCHEMBL18323721 0.68 CRHR1 (0.41) JAK3JAK2JAK1ARALDH1A1
SCHEMBL18517389 0.67 AR (0.46) ARALDH1A1PDK2CRHR1HSD17B10
SCHEMBL372275 0.67 ALDH1A1 (0.58) JAK3JAK2JAK1ALDH1A1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed