SCHEMBL20264227

SCHEMBL20264227

CC(C)(C)OC(=O)N[C@H]1CSc2ccc(C(=O)NCCC(F)(F)F)cc2N(Cc2ccc(Cl)cc2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 8/20 0.49
▸ MAPT P10636 6/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ LMNA P02545 1/20 0.47
▸ NPC1 O15118 1/20 0.44

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
SCHEMBL20264008 0.96 TP53 (0.48) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20264052 0.91 MAPT (0.49) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20263978 0.90 ALDH1A1 (0.51) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20264056 0.89 TP53 (0.46) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20264063 0.89 MAPT (0.46) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20263976 0.89 TP53 (0.44) TP53MAPTSMN1; SMN2NPC1
SCHEMBL20264069 0.89 MAPT (0.47) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20264147 0.88 NPC1 (0.42) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL26961716 0.88 NPC1 (0.46) TP53MAPTSMN1; SMN2LMNANPC1
SCHEMBL20264123 0.88 MAPT (0.38) TP53MAPTSMN1; SMN2LMNANPC1

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 2084/4885MAPT 2443/4885SMN1; SMN2 3392/4885
US-20180170888-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES USEFUL FOR THE TREATMENT OF NEOPLASTIC AND/OR INFECTIOUS DISEASES CCNT2, HRH4, HRH3 TP53 2084/4885MAPT 2443/4885SMN1; SMN2 3392/4885

“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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