SCHEMBL12425005

SCHEMBL12425005

CN(C)c1ccc(F)c(C2=C3C(=O)NC(c4ccccc4C(F)(F)F)=C3C(=O)N2)c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 4/20 0.53
JAK2 O60674 1/20 0.53
JAK1 P23458 1/20 0.53
STK10 O94804 9/20 0.41
SLK Q9H2G2 9/20 0.41
AR P10275 2/20 0.39
PDK2 Q15119 1/20 0.37
CES1 P23141 1/20 0.35
ACP1 P24666 1/20 0.34
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL12424878 0.86 ALDH1A1 (0.44) JAK3JAK2JAK1ARALDH1A1
SCHEMBL12425008 0.84 STK10 (0.44) JAK3JAK2JAK1STK10SLK
SCHEMBL12424925 0.82 JAK3 (0.49) JAK3JAK2JAK1ARPDK2
SCHEMBL12424904 0.80 STK10 (0.51) STK10SLKCES1ALDH1A1
SCHEMBL12425012 0.78 ALDH1A1 (0.37) JAK3JAK2JAK1ALDH1A1
SCHEMBL12425009 0.74 CHEK1 (0.41) JAK3JAK2JAK1STK10SLK
SCHEMBL12425006 0.73 STK10 (0.56) STK10SLKPDK2CES1ALDH1A1
SCHEMBL12424930 0.70 CES1 (0.50) STK10SLKCES1
SCHEMBL23954121 0.70 ROS1 (0.43) PDK2ALDH1A1
SCHEMBL12424862 0.69 GSK3B (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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