SCHEMBL4821182

SCHEMBL4821182

CCCCCCNc1c(-c2c(F)cccc2Cl)c(Cl)nc2ncnn12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ENPP1 P22413 4/20 0.39
GAA P10253 3/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
ABL1 P00519 1/20 0.36
EGFR P00533 1/20 0.34
FGFR1 P11362 1/20 0.34
TP53 P04637 1/20 0.34
CRHR1 P34998 1/20 0.34
TSHR P16473 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
SCHEMBL4817006 0.82 ALDH1A1 (0.37) SMN1; SMN2MEN1KMT2AENPP1GAA
SCHEMBL5799864 0.82 GAA (0.36) SMN1; SMN2MEN1KMT2AENPP1GAA
SCHEMBL4817281 0.82 CRHR1 (0.41) SMN1; SMN2KMT2AENPP1GAAALDH1A1
SCHEMBL4814229 0.81 ALDH1A1 (0.38) SMN1; SMN2MEN1KMT2AENPP1GAA
SCHEMBL4819483 0.81 MBOAT4 (0.36) SMN1; SMN2KMT2AENPP1GAAALDH1A1
SCHEMBL4814273 0.81 GAA (0.40) SMN1; SMN2MEN1KMT2AENPP1GAA
SCHEMBL5234925 0.81 ENPP1 (0.46) SMN1; SMN2ENPP1GAAALDH1A1LMNA
SCHEMBL6997181 0.80 ALDH1A1 (0.38) MEN1KMT2AENPP1GAAALDH1A1
SCHEMBL5802573 0.80 ALDH1A1 (0.35) SMN1; SMN2MEN1KMT2AENPP1GAA
SCHEMBL4821121 0.80 ALDH1A1 (0.41) SMN1; SMN2KMT2AENPP1GAAALDH1A1

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 8 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
EP-1307200-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS Wyeth (US) 2003-05-07 EP claimed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US claimed
WO-2002002563-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS WYETH (US) 2002-01-10 WO claimed
US-7329663-B2 Substituted-triazolopyrimidines as anticancer agents WYETH (US) 2008-02-12 US disclosed
EP-1307200-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS Wyeth (US) 2003-05-07 EP disclosed
US-20020068744-A1 Substituted-triazolopyrimidines as anticancer agents AMERICAN HOME PRODUCTS CORPORATION 2002-06-06 US disclosed
WO-2002002563-A2 SUBSTITUTED-TRIAZOLOPYRIMIDINES AS ANTICANCER AGENTS WYETH (US) 2002-01-10 WO 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 SMN1; SMN2 655/4885MEN1 2807/4885KMT2A 2012/4885

“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.