SCHEMBL20264146

SCHEMBL20264146

CC(C)NC(=O)c1ccc2c(c1)N(Cc1ccc(Cl)c(F)c1)C(=O)[C@@H](NC(=O)OC(C)(C)C)CS2

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 5/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ SRC P12931 3/20 0.40
▸ XIAP P98170 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPT P10636 3/20 0.37
▸ LMNA P02545 1/20 0.37

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
SCHEMBL20264269 0.93 TP53 (0.44) TP53NPC1SRCXIAP
SCHEMBL20264309 0.91 TP53 (0.51) TP53NPC1SRCXIAPSMN1; SMN2
SCHEMBL20263987 0.89 NPC1 (0.44) TP53NPC1SRCXIAPSMN1; SMN2
SCHEMBL20264360 0.86 TP53 (0.49) TP53NPC1SRCXIAPSMN1; SMN2
SCHEMBL20264217 0.85 TP53 (0.55) TP53NPC1XIAPSMN1; SMN2MAPT
SCHEMBL20264074 0.85 TP53 (0.55) TP53NPC1XIAPSMN1; SMN2MAPT
SCHEMBL20264186 0.85 TP53 (0.55) TP53NPC1XIAPSMN1; SMN2MAPT
SCHEMBL20264329 0.85 MAPT (0.37) TP53SMN1; SMN2MAPT
SCHEMBL20264135 0.84 XIAP (0.38) NPC1SRCXIAPMAPT
SCHEMBL20264038 0.83 NPC1 (0.47) TP53NPC1XIAPSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10472341-B2 Bicyclic tetrahydrothiazepine derivatives useful for the treatment of neoplastic and/or infectious diseases APEIRON BIOLOGICS AG (AT) 2019-11-12 — — US disclosed
US-10472341-B2 Bicyclic tetrahydrothiazepine derivatives useful for the treatment of neoplastic and/or infectious diseases APEIRON BIOLOGICS AG (AT) 2019-11-12 — — US disclosed
EP-3265463-B1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES APEIRON BIOLOGICS AG (AT) 2018-12-19 — — EP disclosed
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES APEIRON BIOLOGICS GMBH (AT) 2018-06-21 — — US disclosed
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES APEIRON BIOLOGICS GMBH (AT) 2018-06-21 — — 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 (2 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-10472341-B2 Bicyclic tetrahydrothiazepine derivatives useful for the treatment of neoplastic and/or infectious diseases CCNT2, HRH4, HRH3 TP53 2084/4885NPC1 563/4885SRC 3256/4885
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES CCNT2, HRH4, HRH3 TP53 2084/4885NPC1 563/4885SRC 3256/4885

“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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