SCHEMBL17356271

SCHEMBL17356271

CC(C)NCC(F)(F)Br

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
SCHEMBL104973 0.77
Hydrochloric Acid SCHEMBL28571213 0.74 CTSS (0.35)
SCHEMBL15114005 0.74
SCHEMBL22047390 0.74
SCHEMBL24875185 0.72
SCHEMBL19091095 0.72
SCHEMBL15114059 0.70
SCHEMBL24875274 0.70
Hydrochloric Acid SCHEMBL17700778 0.70
SCHEMBL24770329 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-2955181-B1 TRICYCLIC PYRROLOPYRIDINE COMPOUND, AND JAK INHIBITOR NISSAN CHEMICAL CORP (JP) 2019-10-30 EP disclosed
US-9475813-B2 Tricyclic pyrrolopyridine compound, and JAK inhibitor NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-10-25 US disclosed
US-20150368245-A1 TRICYCLIC PYRROLOPYRIDINE COMPOUND, AND JAK INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-24 US disclosed