SCHEMBL17136152

SCHEMBL17136152

CC(=O)C1(Br)C=CC([N+](=O)[O-])=CC1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2259142 0.74
SCHEMBL21331725 0.74
SCHEMBL30987567 0.74 HSD11B1 (0.37)
SCHEMBL7759919 0.73
SCHEMBL10623983 0.72 TDP1 (0.31)
SCHEMBL27545401 0.72 CYP3A4 (0.38)
SCHEMBL8438478 0.69
SCHEMBL9763476 0.69 CYP19A1 (0.30)
SCHEMBL18683387 0.69
SCHEMBL4754696 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2917190-B1 NEW BENZENE SULFONAMIDE THIAZOLE COMPOUNDS INST NAT DE LA SANTÉ ET DE LA RECH MÉDICALE (INSERM) (FR) 2017-07-19 EP disclosed
US-9567310-B2 Benzene sulfonamide thiazole compounds INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHARCHE MEDICALE) (FR) 2017-02-14 US disclosed
US-20150284347-A1 NEW BENZENE SULFONAMIDE THIAZOLE COMPOUNDS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2015-10-08 US disclosed