SCHEMBL24945210

SCHEMBL24945210

Cc1cc(Nc2ncnc3cnc(N(C)[C@@H]4CCOC4)nc23)ccc1Oc1ccn2ncnc2c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 16/20 0.53
EGFR P00533 8/20 0.53
NQO2 P16083 1/20 0.52
FECH P22830 1/20 0.52
MYH14 Q7Z406 1/20 0.52
RIPK3 Q9Y572 1/20 0.52
BRAF P15056 1/20 0.51

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
SCHEMBL24944108 1.00 ERBB2 (0.53) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945408 0.96 EGFR (0.51) ERBB2EGFRNQO2FECHMYH14
SCHEMBL27197466 0.96 EGFR (0.51) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945212 0.96 EGFR (0.51) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945419 0.94 ERBB2 (0.54) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24173379 0.93 EGFR (0.49) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945522 0.93 EGFR (0.49) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945194 0.89 EGFR (0.51) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945410 0.89 EGFR (0.51) ERBB2EGFRNQO2FECHMYH14
SCHEMBL24945131 0.88 ERBB2 (0.53) ERBB2EGFRNQO2FECHMYH14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11834453-B2 Substituted pyrimido[5,4-d]pyrimidines as HER2 inhibitors ARRAY BIOPHARMA INC. (US) 2023-12-05 US disclosed
US-11834453-B2 Substituted pyrimido[5,4-d]pyrimidines as HER2 inhibitors ARRAY BIOPHARMA INC. (US) 2023-12-05 US disclosed
US-20230023851-A1 HER2 MUTATION INHIBITORS ARRAY BIOPHARMA INC. (US) 2023-01-26 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 (2 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-11834453-B2 Substituted pyrimido[5,4-d]pyrimidines as HER2 inhibitors ERBB2, EGFR, ERBB3 ERBB2 1/4885EGFR 2/4885NQO2 405/4885
US-20230023851-A1 HER2 MUTATION INHIBITORS ERBB2, EGFR, ERBB3 ERBB2 1/4885EGFR 2/4885NQO2 772/4885

“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.