SCHEMBL16004403

SCHEMBL16004403

COC(=O)[C@@]1(F)C[C@@H]2C=C[C@H]1O2

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
SCHEMBL15995260 1.00
SCHEMBL16904319 0.79
SCHEMBL580780 0.65 MAPK1 (0.35)
SCHEMBL15995035 0.64 MAPK1 (0.32)
SCHEMBL13525792 0.64 CYP2D6 (0.35)
SCHEMBL16004404 0.64 MAPK1 (0.32)
SCHEMBL12628450 0.61
SCHEMBL27300233 0.61
SCHEMBL6777708 0.61
SCHEMBL10684385 0.60

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
EP-2961748-B1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed
EP-2961748-B1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-03-28 EP disclosed
US-9492460-B2 Carbazole compounds useful as bromodomain inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-11-15 US disclosed
US-9492460-B2 Carbazole compounds useful as bromodomain inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-11-15 US disclosed
US-9492460-B2 Carbazole compounds useful as bromodomain inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-11-15 US disclosed
US-20140256700-A1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2014-09-11 US disclosed
US-20140256700-A1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2014-09-11 US disclosed
US-20140256700-A1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2014-09-11 US disclosed
WO-2014134232-A1 CARBAZOLE COMPOUNDS USEFUL AS BROMODOMAIN INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-09-04 WO disclosed