SCHEMBL25094351

SCHEMBL25094351

CCCNC(=O)c1ccc(-c2cccc(C(C)(C)C)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.61
▸ RXRB P28702 1/20 0.61
▸ ALDH1A1 P00352 3/20 0.56
▸ POLB P06746 2/20 0.56
▸ DRD2 P14416 2/20 0.54
▸ DRD4 P21917 2/20 0.54
▸ DRD3 P35462 2/20 0.54
▸ ERN1 O75460 1/20 0.51
▸ NPC1 O15118 4/20 0.50
▸ RAB9A P51151 4/20 0.50
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ EGFR P00533 1/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ HPGD P15428 2/20 0.49
▸ TP53 P04637 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ MEN1 O00255 1/20 0.48

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
SCHEMBL25094360 0.86 RXRA (0.57) RXRARXRBALDH1A1NPC1RAB9A
SCHEMBL25450894 0.84 RXRA (0.54) RXRARXRBALDH1A1POLBDRD2
SCHEMBL14615882 0.82 RAB9A (0.68) ALDH1A1POLBNPC1RAB9AL3MBTL1
SCHEMBL1927649 0.81 DRD2 (0.77) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL24582834 0.78 ALDH1A1 (0.49) RXRARXRBALDH1A1DRD2DRD4
SCHEMBL1927120 0.77 L3MBTL1 (0.67) ALDH1A1POLBDRD2DRD4DRD3
SCHEMBL14640450 0.76 RAB9A (0.52) ALDH1A1NPC1RAB9AL3MBTL1SMN1; SMN2
SCHEMBL13422461 0.76 RXRB (1.00) RXRARXRB
SCHEMBL13524610 0.76 RXRB (0.76) RXRARXRBSMN1; SMN2MAPT
SCHEMBL1928116 0.76 ERN1 (0.64) ALDH1A1POLBDRD2DRD4DRD3

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 2 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-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 RXRA 2426/4885RXRB 1594/4885ALDH1A1 1973/4885
US-20230064360-A1 HETEROCYCLES AND USES THEREOF KRAS, HRAS, TP53 RXRA 2624/4885RXRB 2300/4885ALDH1A1 3709/4885

“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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