SCHEMBL25094874

SCHEMBL25094874

CC(C)N1CCN(c2cc(C(N)=O)c(N)nn2)CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.40
▸ HRH3 Q9Y5N1 9/20 0.38
▸ PARP1 P09874 4/20 0.37
▸ PARP2 Q9UGN5 2/20 0.36
▸ TGFBR1 P36897 1/20 0.36
▸ ACVR1 Q04771 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ F12 P00748 3/20 0.35
▸ F2 P00734 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
SCHEMBL4176041 0.72 HRH3 (0.54) HRH3
SCHEMBL23329535 0.69 HRH3 (0.41) PTPN11HRH3F12
SCHEMBL12750887 0.69 HRH3 (0.46) PTPN11HRH3PARP1PARP2F12
SCHEMBL1744941 0.69 HRH3 (0.44) HRH3KDM4EALDH1A1MAPTPKM
SCHEMBL18291486 0.68 HRH3 (0.50) HRH3KDM4EALDH1A1MAPTPKM
SCHEMBL32691733 0.68 MAPT (0.50) HRH3TGFBR1ACVR1KDM4EALDH1A1
SCHEMBL4467331 0.68 HRH3 (0.69) HRH3PARP1
SCHEMBL4197090 0.67 HRH3 (0.46) HRH3
SCHEMBL2829654 0.66 HRH3 (0.47) HRH3
SCHEMBL4188217 0.66 HRH3 (0.40) PTPN11HRH3KDM4EALDH1A1MAPT

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-11648254-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of Ras pathway signaling KUMQUAT BIOSCIENCES INC. (US) 2023-05-16 — — US disclosed
US-11648254-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of Ras pathway signaling KUMQUAT BIOSCIENCES INC. (US) 2023-05-16 — — US disclosed
US-20230064360-A1 HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2023-03-02 — — 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-11648254-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of Ras pathway signaling KRAS, NRAS, BRAF PTPN11 441/4885HRH3 2050/4885PARP1 856/4885
US-20230064360-A1 HETEROCYCLES AND USES THEREOF KRAS, HRAS, TP53 PTPN11 682/4885HRH3 1974/4885PARP1 2392/4885

“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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