SCHEMBL24500208

SCHEMBL24500208

Cc1sc(NC(=O)[C@@H](N)CC(=O)OCC(C)C)c(C(=O)c2ccc(Cl)cc2)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 11/20 0.48
▸ MAPT P10636 8/20 0.48
▸ LMNA P02545 4/20 0.48
▸ HPGD P15428 9/20 0.44
▸ PLA2G1B P04054 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ATG4B Q9Y4P1 1/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ POLB P06746 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 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
SCHEMBL30411459 0.89 ALDH1A1 (0.53) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL19171831 0.86 ALDH1A1 (0.47) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL20466960 0.85 ALDH1A1 (0.42) ALDH1A1MAPTLMNAHPGDNPSR1
SCHEMBL872772 0.85 BRD4 (0.49) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL872773 0.85 BRD4 (0.49) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL15281425 0.84 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL23728786 0.84 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL19136021 0.84 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL31498738 0.83 ALDH1A1 (0.54) ALDH1A1MAPTLMNAHPGDPLA2G1B
SCHEMBL24182336 0.82 ALDH1A1 (0.51) ALDH1A1MAPTLMNAHPGDPLA2G1B

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-20220177490-A1 COMPOUNDS HAVING BOTH EFFECTS OF BET BROMODOMAIN PROTEIN INHIBITION AND PD-L1 GENE REGULATION MEDSHINE DISCOVERY INC. (CN) 2022-06-09 — — 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-20220177490-A1 COMPOUNDS HAVING BOTH EFFECTS OF BET BROMODOMAIN PROTEIN INHIBITION AND PD-L1 GENE REGULATION BET1, BRD4, BRD3 ALDH1A1 2723/4885MAPT 2624/4885LMNA 2322/4885

“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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