SCHEMBL10883181

SCHEMBL10883181

CCC(Br)(C(=O)O)C(=O)C(Br)(CC)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
CYP1A2 P05177 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.33
FFAR3 O14843 1/20 0.33
GRM2 Q14416 1/20 0.33
GRM3 Q14832 1/20 0.33
THRB P10828 1/20 0.33
TSHR P16473 2/20 0.32
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL9154262 0.88 FFAR3 (0.37) MEN1CYP1A2KMT2AALDH1A1FFAR3
SCHEMBL1533575 0.85 CES2 (0.36) MEN1CYP1A2KMT2A
SCHEMBL6916243 0.81 GRM2 (0.32) MEN1CYP1A2KMT2AALDH1A1FFAR3
SCHEMBL1408704 0.74 PIN1 (0.42) MEN1CYP1A2KMT2AALDH1A1THRB
SCHEMBL1449044 0.71
SCHEMBL510845 0.71
SCHEMBL8679764 0.71 CES1 (0.52) MEN1CYP1A2KMT2AALDH1A1TSHR
SCHEMBL4423823 0.69
SCHEMBL287909 0.69
Bromide SCHEMBL11404129 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0005379-B2 PHOTOSENSITIVE COMPOSITIONS CONTAINING CARBONYLIC HALIDES AS ACTIVATORS Dynachem Corporation (US) 1986-06-04 EP disclosed
US-4552830-A UNSATURATED COMPOUND, FREE RADICAL-PRODUCING PHOTOINITIATOR FLUORA COLOR FORMER, PROTON DONOR DYNACHEM CORPORATION (US) 1985-11-12 US disclosed
EP-0005379-B1 PHOTOSENSITIVE COMPOSITIONS CONTAINING CARBONYLIC HALIDES AS ACTIVATORS Dynachem Corporation (US) 1981-12-23 EP disclosed
EP-0005379-A2 Photosensitive compositions containing carbonylic halides as activators Dynachem Corporation (US) 1979-11-14 EP disclosed