SCHEMBL23915974

SCHEMBL23915974

N#Cc1cc(N)ccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.52
ALOX5AP P20292 1/20 0.50
FEN1 P39748 1/20 0.50
XDH P47989 1/20 0.47
PTPN5 P54829 1/20 0.42
TSHR P16473 2/20 0.42
GLA P06280 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 3/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
USP2 O75604 1/20 0.40
KDM1A O60341 1/20 0.39
AR P10275 1/20 0.39
MEN1 O00255 1/20 0.39
ALOX15 P16050 1/20 0.39
BRCA1 P38398 1/20 0.39

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
SCHEMBL3898071 0.90 ALOX5AP (0.56) KIF11ALOX5APFEN1XDHPTPN5
SCHEMBL30101062 0.84 KDM4E (0.48) ALOX5APFEN1ALDH1A1KDM4EMAPT
SCHEMBL23915997 0.82 ALOX5AP (0.44) KIF11ALOX5APFEN1XDHTSHR
SCHEMBL20329163 0.80 STS (0.44) ALOX5APFEN1XDHGAAALDH1A1
SCHEMBL5851644 0.79 KIF11 (0.63) KIF11TSHRGLAPOLBGAA
SCHEMBL8111393 0.78 KDM4E (0.45) XDHTSHRALDH1A1KDM4EMAPT
SCHEMBL21071606 0.78 ALOX5AP (0.46) ALOX5APFEN1XDHTSHRGLA
SCHEMBL23916000 0.78 KDM4E (0.46) ALOX5APFEN1XDHTSHRGLA
SCHEMBL22780766 0.78 KDM4E (0.53) XDHGAAALDH1A1KDM4EMAPT
SCHEMBL30533023 0.78 KDM4E (0.53) XDHGAAALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-10-14 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-20210317092-A1 TETRAZOLE CONTAINING COMPOUNDS TSLP, IL5, TRPA1 KIF11 3016/4885ALOX5AP 419/4885FEN1 4761/4885

“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.