SCHEMBL23325913

SCHEMBL23325913

CCNc1ccc(C(=O)N(C)C(C)C)cn1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HCAR3 P49019 13/20 0.61
▸ HCAR2 Q8TDS4 2/20 0.50
▸ GRM5 P41594 1/20 0.43
▸ ADRA2A P08913 1/20 0.41
▸ ADRA2B P18089 1/20 0.41
▸ ADRA2C P18825 1/20 0.41
▸ GABRA5 P31644 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL25884637 0.82 HCAR3 (0.65) HCAR3HCAR2GRM5GABRA5
SCHEMBL186420 0.77 HCAR3 (1.00) HCAR3HCAR2
SCHEMBL5429479 0.75 HDAC1 (0.50) GABRA5ALDH1A1
SCHEMBL11546416 0.75 HCAR3 (0.73) HCAR3HCAR2ADRA2AADRA2BADRA2C
SCHEMBL692654 0.74 HCAR3 (0.71) HCAR3HCAR2ADRA2AADRA2BADRA2C
SCHEMBL23341627 0.74 GABRA5 (0.42) HCAR3HCAR2GABRA5ALDH1A1
SCHEMBL31661260 0.73 HCAR3 (0.69) HCAR3HCAR2ADRA2AADRA2BADRA2C
SCHEMBL24101021 0.72 HCAR3 (0.67) HCAR3HCAR2ALDH1A1LMNA
SCHEMBL25905785 0.71 ADRA2A (0.40) HCAR3ADRA2AADRA2BADRA2CALDH1A1
SCHEMBL25905786 0.71 HCAR3 (0.61) HCAR3HCAR2GRM5ALDH1A1

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-20230234929-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 — — US disclosed
US-11566007-B2 Ras inhibitors Revolution Medicines, Inc. (US) 2023-01-31 — — US disclosed
US-20210130303-A1 RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2021-05-06 — — 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 (3 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-11566007-B2 Ras inhibitors KRAS, NRAS, HRAS HCAR3 4500/4885HCAR2 4728/4885GRM5 4633/4885
US-20230234929-A1 RAS INHIBITORS KRAS, NRAS, HRAS HCAR3 4500/4885HCAR2 4728/4885GRM5 4633/4885
US-20210130303-A1 RAS INHIBITORS KRAS, NRAS, HRAS HCAR3 4500/4885HCAR2 4728/4885GRM5 4633/4885

“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.

Send feedback