SCHEMBL11215657

SCHEMBL11215657

C=Cc1ccc(CC)c(CC)c1C

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
SCHEMBL17160046 0.84
SCHEMBL585023 0.83
SCHEMBL29144410 0.82
Hydrochloric Acid SCHEMBL28664970 0.80
SCHEMBL11437595 0.78 ESR2 (0.36)
SCHEMBL29051014 0.78 PDXK (0.30)
SCHEMBL5278369 0.77
SCHEMBL9310273 0.77 THRB (0.33)
SCHEMBL9310057 0.74 THRB (0.33)
SCHEMBL12802027 0.74 GABRA1 (0.31)

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-4327191-A THEN AMINATING RHONE-POULENC INDUSTRIES (FR) 1982-04-27 US claimed
EP-0025385-A1 Preparation of anion-exchange resins by bromination of vinylaromatic polymers, and products obtained RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1981-03-18 EP claimed
EP-0025385-B1 PREPARATION OF ANION-EXCHANGE RESINS BY BROMINATION OF VINYLAROMATIC POLYMERS, AND PRODUCTS OBTAINED RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1983-05-11 EP disclosed
US-4327191-A THEN AMINATING RHONE-POULENC INDUSTRIES (FR) 1982-04-27 US disclosed
EP-0025385-A1 Preparation of anion-exchange resins by bromination of vinylaromatic polymers, and products obtained RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1981-03-18 EP disclosed