SCHEMBL18723977

SCHEMBL18723977

Nc1nc(-c2cc(C(F)(F)F)cs2)cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 6/20 0.54
LTA4H P09960 4/20 0.49
ALDH1A1 P00352 7/20 0.44
MAPT P10636 5/20 0.44
NPC1 O15118 4/20 0.44
HSD17B10 Q99714 2/20 0.44
GFER P55789 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
RAB9A P51151 4/20 0.41
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38

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
SCHEMBL3278201 0.76 LTA4H (0.58) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL23364762 0.74 MPL (0.53) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL1801097 0.74 MPL (0.65) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL18724191 0.73 MAPT (0.53) LTA4HALDH1A1MAPTNPC1HSD17B10
SCHEMBL474291 0.73 LTA4H (0.82) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL2762616 0.72 MPL (0.51) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL1665356 0.72 ALDH1A1 (0.48) MPLLTA4HALDH1A1MAPTNPC1
SCHEMBL16003687 0.72 ALDH1A1 (0.58) LTA4HALDH1A1MAPTNPC1HSD17B10
SCHEMBL18724187 0.71 MEN1 (0.47) ALDH1A1MAPTNPC1HSD17B10RAB9A
SCHEMBL474188 0.71 MAPT (0.55) MPLLTA4HALDH1A1MAPTNPC1

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-RE49111-E1 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2022-06-21 US disclosed
EP-3153511-B1 2-ACYLAMINOTHIAZOLE DERIVATIVE FOR USE IN THE PREVENTION OR TREATMENT OF BLADDER/URINARY TRACT DISEASES ASTELLAS PHARMA INC (JP) 2019-05-15 EP disclosed
US-9951060-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2018-04-24 US disclosed
US-20170197955-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2017-07-13 US disclosed
EP-3153511-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2017-04-12 EP 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-20170197955-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF CHRM3, CHRM2, TRPM2 MPL 3647/4885LTA4H 1000/4885ALDH1A1 1551/4885

“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.