SCHEMBL24488622

SCHEMBL24488622

CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@@H](Oc2ccccc2)CC1Cn1cc(C(C)=O)c2cc(F)ccc21)C1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BIRC3 Q13489 13/20 0.47
▸ XIAP P98170 12/20 0.47
▸ TNF P01375 8/20 0.43
▸ CNR1 P21554 1/20 0.39

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
SCHEMBL24067350 1.00 BIRC3 (0.47) BIRC3XIAPTNFCNR1
SCHEMBL22450652 1.00 BIRC3 (0.47) BIRC3XIAPTNFCNR1
SCHEMBL22450678 1.00 BIRC3 (0.47) BIRC3XIAPTNFCNR1
SCHEMBL24488623 0.88 BIRC3 (0.50) BIRC3XIAPTNFCNR1
SCHEMBL24488641 0.88 CNR1 (0.39) BIRC3XIAPCNR1
SCHEMBL24067462 0.87 XIAP (0.36) BIRC3XIAPTNFCNR1
SCHEMBL24488639 0.86 CNR1 (0.41) CNR1
SCHEMBL24182198 0.84 TNF (0.53) BIRC3XIAPTNFCNR1
SCHEMBL22450711 0.84 TNF (0.53) BIRC3XIAPTNFCNR1
SCHEMBL22450736 0.84 TNF (0.53) BIRC3XIAPTNFCNR1

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-20220175917-A1 COMBINATION OF IAP INHIBITOR AND IMMUNE CHECKPOINT INHIBITOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (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-20220175917-A1 COMBINATION OF IAP INHIBITOR AND IMMUNE CHECKPOINT INHIBITOR BIRC5, XIAP, BIRC2 BIRC3 4/4885XIAP 2/4885TNF 1106/4885

“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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