SCHEMBL2560765

SCHEMBL2560765

C=C(Br)COc1c(C)cc(C=O)cc1C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.47
ALDH1A1 P00352 6/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.37
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.33
LMNA P02545 2/20 0.33
MAOA P21397 3/20 0.33
MAOB P27338 3/20 0.33
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL2559894 0.83 SRC (0.47) SRCALDH1A1MAPK1L3MBTL1CYP1A2
SCHEMBL2554357 0.81 ALDH1A1 (0.58) ALDH1A1MAPK1L3MBTL1CYP1A2CYP2C19
SCHEMBL146965 0.79 SRC (0.50) SRCALDH1A1MAPK1L3MBTL1KMT2A
SCHEMBL349748 0.78 ALDH1A1 (0.58) SRCALDH1A1MAPK1L3MBTL1CYP1A2
SCHEMBL7683038 0.77 SRC (0.47) SRCALDH1A1MAPK1L3MBTL1CYP1A2
SCHEMBL13858739 0.77 ALDH1A1 (0.53) SRCALDH1A1MAPK1L3MBTL1CYP1A2
SCHEMBL5351709 0.76 SRC (0.53) SRCALDH1A1MAPK1L3MBTL1CYP1A2
SCHEMBL15331168 0.76 ALDH1A1 (0.71) ALDH1A1MAPK1CYP1A2CYP2C19MEN1
SCHEMBL2554336 0.75 ALDH1A1 (0.54) SRCALDH1A1MAPK1L3MBTL1MEN1
SCHEMBL15331183 0.75 ALDH1A1 (0.72) ALDH1A1MAPK1L3MBTL1CYP1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed