SCHEMBL14804201

SCHEMBL14804201

N#CC1CCN(c2c(F)cccc2Cl)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 7/20 0.56
EGLN2 Q96KS0 1/20 0.41
NOTUM Q6P988 2/20 0.40
EED O75530 1/20 0.38
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
C5AR1 P21730 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
CYP2A13 Q16696 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE7A Q13946 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
SCHEMBL30413179 0.89 KDM4E (0.65) KDM4EALDH1A1EGLN2NOTUMEED
Hydrochloric Acid SCHEMBL30411740 0.87 KDM4E (0.63) KDM4EALDH1A1EGLN2NOTUMEED
SCHEMBL30079590 0.80 HTR3E (0.47) NOTUMC5AR1
SCHEMBL28348705 0.78 KDM4E (0.53) KDM4EALDH1A1EGLN2NOTUMEED
SCHEMBL23064539 0.77 ALDH1A1 (0.48) KDM4EALDH1A1GAAL3MBTL1CYP2A13
SCHEMBL14804180 0.74 ALDH1A1 (0.41) KDM4EALDH1A1EGLN2EEDFFAR4
Hydrochloric Acid SCHEMBL8729997 0.74 KDM4E (0.55) KDM4EALDH1A1EGLN2NOTUMGAA
SCHEMBL27850036 0.74 KDM4E (0.72) KDM4EALDH1A1EGLN2NOTUMHPGD
SCHEMBL2072485 0.73 KDM4E (1.00) KDM4EALDH1A1EGLN2EEDGAA
SCHEMBL13125293 0.72 ALDH1A1 (0.40) KDM4EALDH1A1FFAR4

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-8765764-B2 2-acylaminothiazole derivative or salt thereof ASTELLAS PHARMA, INC. (JP) 2014-07-01 US disclosed
US-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA, INC. (JP) 2013-03-28 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-20130079351-A1 2-ACYLAMINOTHIAZOLE DERIVATIVE OR SALT THEREOF MPL, JAK2, ABL1 KDM4E 1499/4885ALDH1A1 2060/4885EGLN2 3830/4885

“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.