Anatibant

Anatibant

SCHEMBL29403189

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)N4CCC[C@@H]4C(=O)NCCCNC(=O)c4ccc(C(=N)N)cc4)c3Cl)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

BDKRB2

The experimentally established mechanism targets of Anatibant. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BDKRB2 known ✓ P30411 4/20 1.00
RORC P51449 16/20 0.62

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
Anatibant SCHEMBL6945415 1.00 BDKRB2 (1.00) BDKRB2RORC
Anatibant SCHEMBL29379305 1.00 BDKRB2 (1.00) BDKRB2RORC
Anatibant SCHEMBL1649974 1.00 BDKRB2 (1.00) BDKRB2RORC
Anatibant SCHEMBL8045259 0.99 BDKRB2 (0.99) BDKRB2RORC
Anatibant SCHEMBL29711321 0.99 BDKRB2 (0.98) BDKRB2RORC
Anatibant SCHEMBL8045426 0.99 BDKRB2 (0.98) BDKRB2RORC
SCHEMBL6948870 0.99 BDKRB2 (0.98) BDKRB2RORC
SCHEMBL6950081 0.98 BDKRB2 (0.96) BDKRB2RORC
Hydrochloric Acid SCHEMBL8040359 0.98 BDKRB2 (0.95) BDKRB2RORC
SCHEMBL6953304 0.98 BDKRB2 (0.95) BDKRB2RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240074995-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FIRST WAVE BIO, INC. 2024-03-07 US disclosed
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FIRST WAVE BIO, INC. (US) 2023-10-24 US disclosed
US-11744812-B2 Methods of treatment FIRST WAVE BIO, INC. (US) 2023-09-05 US disclosed
US-20230201143-A1 METHODS OF TREATMENT FIRST WAVE BIO, INC. 2023-06-29 US disclosed
US-20230102999-A1 DEUTERATED NICLOSAMIDE FIRST WAVE BIO, INC. 2023-03-30 US disclosed
US-11564896-B2 Methods of treatment FIRST WAVE BIO, INC. (US) 2023-01-31 US disclosed
EP-4045480-A1 PHARMACEUTICAL FORMULATIONS First Wave Bio, Inc. (US) 2022-08-24 EP disclosed
US-20220105057-A1 METHODS OF TREATMENT FIRST WAVE BIO, INC. 2022-04-07 US disclosed
US-20220079897-A1 METHODS OF TREATMENT FIRST WAVE BIO, INC. 2022-03-17 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 (8 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-20240074995-A1 METHODS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH AN ABNORMAL INFLAMMATORY RESPONSES FH, CS, ECHS1 BDKRB2 2339/4885RORC 553/4885
US-20220079897-A1 METHODS OF TREATMENT ACE2, ACE, SI BDKRB2 3277/4885RORC 2460/4885
US-11744812-B2 Methods of treatment ACE2, ACE, SI BDKRB2 3277/4885RORC 2460/4885
US-20230201143-A1 METHODS OF TREATMENT ACE2, ACE, SI BDKRB2 3530/4885RORC 2859/4885
US-11564896-B2 Methods of treatment ACE2, ACE, SI BDKRB2 3530/4885RORC 2859/4885
US-20220105057-A1 METHODS OF TREATMENT ACE2, ACE, SI BDKRB2 3530/4885RORC 2859/4885
US-20230102999-A1 DEUTERATED NICLOSAMIDE FH, IDH2, ECHS1 BDKRB2 2693/4885RORC 611/4885
US-11793777-B2 Methods and compositions for treating conditions associated with an abnormal inflammatory response FH, CS, ECHS1 BDKRB2 2229/4885RORC 534/4885

“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.