SCHEMBL4818079

SCHEMBL4818079

CC(C)Nc1c(-c2ccc(F)c(F)c2)c(Cl)nc2ncnn12

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 5/20 0.39
▸ TSHR P16473 3/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ HPGD P15428 3/20 0.38
▸ PDE2A O00408 4/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL4814986 0.86 ALDH1A1 (0.38) KDM4EALDH1A1TSHRKMT2APOLB
SCHEMBL975954 0.82 MAPK1 (0.38) ALDH1A1TSHRKMT2APOLBHPGD
SCHEMBL7497202 0.81 MAPK1 (0.34) ALDH1A1TSHRKMT2APOLBHPGD
SCHEMBL8482833 0.81 MAPK1 (0.37) KDM4EALDH1A1TSHRPOLBHPGD
SCHEMBL4818244 0.81 PDE2A (0.36) KDM4EALDH1A1TSHRHPGDPDE2A
SCHEMBL14270926 0.81 EGLN2 (0.38) KDM4EALDH1A1TSHRKMT2APOLB
SCHEMBL4818127 0.80 ENPP1 (0.45) KDM4EALDH1A1TSHRKMT2APOLB
SCHEMBL5746929 0.80 HTT (0.39) KDM4EALDH1A1TSHRKMT2APOLB
SCHEMBL4708013 0.80 EGLN2 (0.47) —
SCHEMBL7262159 0.80 LMNA (0.39) ALDH1A1TSHRKMT2APOLBHPGD

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 KDM4E 3074/4885ALDH1A1 2231/4885TSHR 2567/4885

“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.

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