SCHEMBL14835486

SCHEMBL14835486

CCC(CC)C(c1cccc(Br)c1)n1ccnc1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.45
CYP17A1 P05093 9/20 0.43
IDO1 P14902 1/20 0.43
CYP11B1 P15538 1/20 0.43
ADRA2C P18825 1/20 0.43
CYP11B2 P19099 1/20 0.43

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
SCHEMBL15551279 0.86 CYP17A1 (0.45) CYP19A1CYP17A1CYP11B1CYP11B2
SCHEMBL14836039 0.83 CYP17A1 (0.58) CYP19A1CYP17A1IDO1CYP11B1CYP11B2
SCHEMBL14836126 0.82 CYP17A1 (0.59) CYP19A1CYP17A1CYP11B1CYP11B2
SCHEMBL9784386 0.78 CYP17A1 (0.60) CYP19A1CYP17A1IDO1CYP11B1ADRA2C
SCHEMBL27912068 0.76 CYP19A1 (0.45) CYP19A1CYP17A1IDO1CYP11B1CYP11B2
SCHEMBL14876867 0.75 CYP26A1 (0.39) CYP19A1CYP17A1
SCHEMBL14837689 0.74 CYP17A1 (0.48) CYP19A1CYP17A1CYP11B1CYP11B2
SCHEMBL9661787 0.74 IDO1 (0.41) CYP19A1CYP17A1IDO1CYP11B1ADRA2C
SCHEMBL14835851 0.70 KDM4E (0.41) CYP19A1CYP17A1
SCHEMBL14835769 0.69 RAB9A (0.50) CYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014093960-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE ANGION BIOMEDICA CORP. (US) 2014-06-19 WO claimed
WO-2014015137-A2 COMPOSITIONS AND METHODS FOR TREATING DYSPROLIFERATIVE DISEASES ANGION BIOMEDICA CORP. (US) 2014-01-23 WO claimed
EP-2576544-A2 CYTOCHROME P450 INHIBITORS AND USES THEREOF Angion Biomedica Corp. (US) 2013-04-10 EP claimed
WO-2011153192-A2 CYTOCHROME P450 INHIBITORS AND USES THEREOF ANGION BIOMEDICA CORP. (US) 2011-12-08 WO claimed
WO-2014093960-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE ANGION BIOMEDICA CORP. (US) 2014-06-19 WO disclosed
WO-2014015137-A2 COMPOSITIONS AND METHODS FOR TREATING DYSPROLIFERATIVE DISEASES ANGION BIOMEDICA CORP. (US) 2014-01-23 WO disclosed
EP-2576544-A2 CYTOCHROME P450 INHIBITORS AND USES THEREOF Angion Biomedica Corp. (US) 2013-04-10 EP disclosed
WO-2011153192-A2 CYTOCHROME P450 INHIBITORS AND USES THEREOF ANGION BIOMEDICA CORP. (US) 2011-12-08 WO disclosed