SCHEMBL4820252

SCHEMBL4820252

CC(Nc1c(-c2ccc(F)cc2F)c(Cl)nc2ncnn12)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 2/20 0.35
ABL1 P00519 1/20 0.35
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
PDE2A O00408 1/20 0.33
HPGD P15428 1/20 0.33
MBOAT4 Q96T53 3/20 0.32

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
SCHEMBL4488801 1.00 MAPK1 (0.40) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL25616317 0.91 HTT (0.37) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL23925449 0.88 EGLN2 (0.46)
SCHEMBL23925452 0.88 EGLN2 (0.46)
SCHEMBL343322 0.87 MAPK1 (0.35) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL976390 0.87 MAPK1 (0.35) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL4818612 0.87 MAPK1 (0.35) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL5593412 0.86 TSHR (0.35) MAPK1KMT2AMEN1GAAALDH1A1
SCHEMBL4810525 0.85 ALDH1A1 (0.31) KMT2AMEN1GAAALDH1A1KDM4E
SCHEMBL14596578 0.84 KMT2A (0.37) MAPK1KMT2AMEN1GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329663-B2 Substituted-triazolopyrimidines as anticancer agents WYETH (US) 2008-02-12 US claimed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US claimed
US-7329663-B2 Substituted-triazolopyrimidines as anticancer agents WYETH (US) 2008-02-12 US disclosed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 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-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents TUBB3, TUBA1C, TUBB1 MAPK1 916/4885KMT2A 2012/4885MEN1 2807/4885

“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.