SCHEMBL25450371

SCHEMBL25450371

CC(C)(C)c1cncc2c1NCCC2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.33
▸ NNMT P40261 1/20 0.33
▸ NISCH Q9Y2I1 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ HTR1A P08908 2/20 0.31
▸ ADRA2A P08913 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM4 P08173 1/20 0.31
▸ CHRM5 P08912 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ADRA2B P18089 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ ADRA1D P25100 1/20 0.31
▸ HTR1D P28221 1/20 0.31
▸ HTR1B P28222 1/20 0.31

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
SCHEMBL27098457 0.77 UHRF1 (0.37) SIGMAR1NNMTLMNAMEN1KMT2A
SCHEMBL10912802 0.75 SRC (0.46) NISCHLMNATSHRHTR2CTDP1
SCHEMBL14031768 0.72 HTR1D (0.38) LMNACYP3A4HTR1AADRA2AMEN1
Hydrochloric Acid SCHEMBL21331756 0.71 NNMT (0.37) SIGMAR1NNMTCHRNB2CHRNA4
SCHEMBL25094789 0.71 ADRA2A (0.34) ADRA2AADRA2BADRA2CADRA1DADRA1A
SCHEMBL21738334 0.71 IRAK4 (0.35) —
SCHEMBL22020513 0.71 CYP11B2 (0.36) SIGMAR1
SCHEMBL21478370 0.71 CYP11B2 (0.39) SIGMAR1
SCHEMBL19103015 0.69 SRC (0.41) NISCHTSHRHTR2CHTR2BTDP1
SCHEMBL4567536 0.69 SRC (0.35) MEN1CYP1A2CYP2C19KMT2A

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 1 patent. 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

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-11648254-B2 Substituted pyrido[2,3-d]pyrimidines as inhibitors of Ras pathway signaling KRAS, NRAS, BRAF SIGMAR1 4382/4885NNMT 1576/4885NISCH 1514/4885

“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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