SCHEMBL25905785

SCHEMBL25905785

CCNc1ccc(C(=O)N(C)C(C)C)nc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 2/20 0.40
▸ ADRA2B P18089 2/20 0.40
▸ ADRA2C P18825 2/20 0.40
▸ P4HTM Q9NXG6 6/20 0.39
▸ RRM2 P31350 1/20 0.36
▸ HDAC3 O15379 3/20 0.36
▸ HDAC1 Q13547 3/20 0.36
▸ HDAC8 Q9BY41 3/20 0.36
▸ HDAC4 P56524 2/20 0.36
▸ HDAC6 Q9UBN7 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.34
▸ HCAR3 P49019 1/20 0.34
▸ LMNA P02545 1/20 0.33
▸ ACACB O00763 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL25041234 0.85 ADRA2A (0.44) ADRA2AADRA2BADRA2CP4HTMRRM2
SCHEMBL23323560 0.82 P4HTM (0.38) P4HTMHDAC3HDAC1HDAC8HDAC4
SCHEMBL23342776 0.80 ALDH1A1 (0.46) P4HTMHDAC3HDAC1HDAC8HDAC4
SCHEMBL25932371 0.80 P4HTM (0.36) P4HTMHDAC3HDAC1HDAC8HDAC4
SCHEMBL30112058 0.77 P4HTM (0.60) ADRA2AADRA2BADRA2CP4HTMALDH1A1
SCHEMBL18405340 0.77 P4HTM (0.60) ADRA2AADRA2BADRA2CP4HTMALDH1A1
SCHEMBL30112066 0.72 CYP1A2 (0.47) ADRA2AADRA2BADRA2CP4HTMALDH1A1
SCHEMBL19555950 0.72 CYP1A2 (0.47) ADRA2AADRA2BADRA2CP4HTMALDH1A1
SCHEMBL23325914 0.71 P4HTM (0.36) P4HTMHDAC3HDAC1HDAC8HDAC4
SCHEMBL23325913 0.71 HCAR3 (0.61) ADRA2AADRA2BADRA2CALDH1A1HCAR3

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-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 — — 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-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS KRAS, HRAS, MTOR ADRA2A 4544/4885ADRA2B 4561/4885ADRA2C 4685/4885

“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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