SCHEMBL25094065

SCHEMBL25094065

CC(C)(C)N1CCNC(c2cccnc2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 9/20 0.51
▸ CHRNA4 P43681 9/20 0.51
▸ CHRNA7 P36544 7/20 0.51
▸ CYP2A6 P11509 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ CYP2D6 P10635 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ ALDH1A1 P00352 2/20 0.41
▸ CHRNB4 P30926 2/20 0.41
▸ CHRNA3 P32297 2/20 0.41
▸ CHRNA2 Q15822 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ HTR3E A5X5Y0 1/20 0.41
▸ PSIP1 O75475 1/20 0.41

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
SCHEMBL25093280 0.84 GSK3B (0.40) CYP2D6
SCHEMBL13093644 0.83 PDE10A (0.40) ALDH1A1
SCHEMBL26675031 0.81 CHRNB2 (0.56) CHRNB2CHRNA4CHRNA7CYP2A6MEN1
SCHEMBL14805866 0.77 CYP11B2 (0.50) CHRNB2CHRNA4CHRNA7CYP2A6ALDH1A1
SCHEMBL12026514 0.75 CYP11B2 (0.51) CHRNB2CHRNA4CHRNA7CYP2A6ALDH1A1
SCHEMBL23982003 0.75 GPR119 (0.52) CHRNB2CHRNA4CHRNA7CYP2A6MEN1
SCHEMBL13841172 0.74 CYP11B2 (0.55) CHRNB2CHRNA4CHRNA7CYP2A6ALDH1A1
SCHEMBL28989369 0.73 CHRNB2 (0.50) CHRNB2CHRNA4CHRNA7CYP2A6MEN1
SCHEMBL13841158 0.73 CYP11B2 (0.57) CHRNB2CHRNA4CHRNA7CYP2A6ALDH1A1
SCHEMBL3956949 0.71 TP53 (0.56) CHRNB2CHRNA4CHRNA7CYP2A6MEN1

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 CHRNB2 3711/4885CHRNA4 4681/4885CHRNA7 4665/4885
US-20230064360-A1 HETEROCYCLES AND USES THEREOF KRAS, HRAS, TP53 CHRNB2 4426/4885CHRNA4 4815/4885CHRNA7 4753/4885

“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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