SCHEMBL19448232

SCHEMBL19448232

CC(=O)Nc1nc(-c2cc(F)c(C)c(C(F)(F)F)c2)cs1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 9/20 0.59
RAB9A P51151 5/20 0.50
NPC1 O15118 5/20 0.50
HSD17B10 Q99714 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALOX15 P16050 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
TYR P14679 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MPL P40238 1/20 0.44
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL18724276 0.85 ABL1 (0.56) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL17400523 0.84 ABL1 (0.70) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL480735 0.84 ABL1 (0.70) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL19448234 0.82 ABL1 (0.65) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL17400600 0.79 ABL1 (0.73) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL18723983 0.78 ABL1 (0.53) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL17386703 0.78 ABL1 (0.55) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL19448229 0.77 PIK3CA (0.44) HSD17B10ALDH1A1MEN1KMT2AHPGD
SCHEMBL16254980 0.77 ABL1 (0.79) ABL1RAB9ANPC1HSD17B10ALDH1A1
SCHEMBL18724406 0.77 ABL1 (0.51) ABL1RAB9ANPC1HSD17B10ALDH1A1

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-9844549-B2 2-aminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2017-12-19 US disclosed
US-20170290824-A1 2-AMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2017-10-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170290824-A1 2-AMINOTHIAZOLE DERIVATIVE OR SALT THEREOF CHRM3, CHRM2, TRPM2 ABL1 2969/4885RAB9A 2245/4885NPC1 4435/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.