SCHEMBL24317141

SCHEMBL24317141

COc1cc(N2CCCc3ccc(NS(C)(=O)=O)cc32)c2cc(C)c(=O)n(C)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 4/20 0.46
▸ KAT2B Q92831 1/20 0.42
▸ BRPF1 P55201 3/20 0.39
▸ BRD4 O60885 3/20 0.39
▸ BRD1 O95696 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ TRIM24 O15164 1/20 0.36
▸ BRD9 Q9H8M2 1/20 0.36
▸ BRD7 Q9NPI1 1/20 0.36
▸ BRPF3 Q9ULD4 1/20 0.36
▸ TUBB4A P04350 1/20 0.36
▸ TUBB P07437 1/20 0.36
▸ TUBA3C P0DPH7 1/20 0.36
▸ TUBA1B P68363 1/20 0.36
▸ TUBA4A P68366 1/20 0.36
▸ TUBB4B P68371 1/20 0.36
▸ TUBB3 Q13509 1/20 0.36

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
SCHEMBL29471267 1.00 NLRP3 (0.46) NLRP3KAT2BBRPF1BRD4BRD1
Water SCHEMBL29471216 0.98 NLRP3 (0.44) NLRP3KAT2BBRPF1BRD4BRD1
SCHEMBL29471230 0.86 RAB9A (0.40) NLRP3ALDH1A1LMNA
SCHEMBL24317142 0.86 RAB9A (0.40) NLRP3ALDH1A1LMNA
SCHEMBL26548842 0.84 BRPF1 (0.41) BRPF1BRD4THRBALDH1A1BRD9
SCHEMBL29471203 0.84 NLRP3 (0.40) NLRP3BRPF1THRBALDH1A1TUBB4A
SCHEMBL26548846 0.84 NLRP3 (0.40) NLRP3BRPF1THRBALDH1A1TUBB4A
SCHEMBL29471266 0.84 CA1 (0.41) NLRP3BRPF1THRBALDH1A1TUBB4A
SCHEMBL29471205 0.84 TP53 (0.38) NLRP3BRPF1THRBALDH1A1TUBB4A
SCHEMBL26548859 0.84 TP53 (0.38) NLRP3BRPF1THRBALDH1A1TUBB4A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-10-12 — — US disclosed
US-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE ONCOLOGY LIMITED (IN) 2023-10-12 — — US disclosed
CN-116368128-A Heterocyclic compounds as CBP/EP300 bromodomain inhibitors 奥瑞基尼肿瘤有限公司 2023-06-30 — — CN disclosed
WO-2022053967-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-03-17 — — WO 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-20230322724-A1 HETEROCYCLIC COMPOUNDS AS CBP/EP300 BROMODOMAIN INHIBITORS EP300, HDAC1, BRD3 NLRP3 2322/4885KAT2B 25/4885BRPF1 216/4885

“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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