SCHEMBL21811832

SCHEMBL21811832

N#Cc1ccc(Br)c(C(F)F)c1F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 3/20 0.36
CYP11B2 P19099 3/20 0.36
TRPV4 Q9HBA0 1/20 0.33
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30

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
SCHEMBL8574987 0.85 CYP11B1 (0.33) CYP11B1CYP11B2TRPV4MAOAMAOB
SCHEMBL21811729 0.80 TRPV4 (0.39) CYP11B1CYP11B2TRPV4
SCHEMBL9447055 0.77 TRPV4 (0.39) CYP11B1CYP11B2TRPV4MAOAMAOB
SCHEMBL8576407 0.76 TDP1 (0.36) TRPV4
SCHEMBL21811583 0.75 PGR (0.33) CYP11B1CYP11B2MAOAMAOB
SCHEMBL30950508 0.74 DYRK1A (0.41)
SCHEMBL16122475 0.74 TRPV4 (0.36) CYP11B1CYP11B2TRPV4MAOAMAOB
SCHEMBL17711239 0.74
SCHEMBL24128013 0.73 TRPV4 (0.37) CYP11B1CYP11B2TRPV4MAOAMAOB
SCHEMBL21811549 0.73

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-12171741-B2 2,3-dihydrobenzo[b]thiophene derivatives as hypoxia inducible factor-2(alpha) inhibitors NIKANG THERAPEUTICS, INC. (US) 2024-12-24 US disclosed
US-20220054451-A1 2,3-DIHYDROBENZO[b]THIOPHENE DERIVATIVES AS HYPOXIA INDUCIBLE FACTOR-2(ALPHA) INHIBITORS NIKANG THERAPEUTICS, INC. 2022-02-24 US disclosed
US-20220054451-A1 2,3-DIHYDROBENZO[b]THIOPHENE DERIVATIVES AS HYPOXIA INDUCIBLE FACTOR-2(ALPHA) INHIBITORS NIKANG THERAPEUTICS, INC. 2022-02-24 US disclosed
EP-3849541-A1 2,3-DIHYDROBENZO[B]THIOPHENE DERIVATIVES AS HYPOXIA INDUCIBLE FACTOR-2(ALPHA) INHIBITORS Nikang Therapeutics, Inc. (US) 2021-07-21 EP disclosed
WO-2020055883-A1 2,3-DIHYDROBENZO[b]THIOPHENE DERIVATIVES AS HYPOXIA INDUCIBLE FACTOR-2(ALPHA) INHIBITORS NIKANG THERAPEUTICS, INC. (US) 2020-03-19 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 (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-20220054451-A1 2,3-DIHYDROBENZO[b]THIOPHENE DERIVATIVES AS HYPOXIA INDUCIBLE FACTOR-2(ALPHA) INHIBITORS HIF1AN, HIF1A, EGLN2 CYP11B1 539/4885CYP11B2 166/4885TRPV4 3778/4885
US-12171741-B2 2,3-dihydrobenzo[b]thiophene derivatives as hypoxia inducible factor-2(alpha) inhibitors HIF1AN, HIF1A, EGLN2 CYP11B1 539/4885CYP11B2 166/4885TRPV4 3778/4885

“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.