SCHEMBL15330205

SCHEMBL15330205

C=C(Br)COc1ccc(Cl)cc1C=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.49
ERN1 O75460 1/20 0.45
ALDH1A1 P00352 4/20 0.43
MAPT P10636 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
PKM P14618 1/20 0.43
PTGDR Q13258 1/20 0.43
TSHR P16473 4/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.39

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
SCHEMBL2557097 0.86 TDP1 (0.47) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL14785422 0.85 HTR2B (0.48) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL14785171 0.84 PTGDR2 (0.44) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL2556401 0.83 PTGDR2 (0.70) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL14785358 0.82 PTGDR2 (0.43) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL14785283 0.82 PTGDR2 (0.43) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL2556226 0.82 PTGDR2 (0.49) PTGDR2ERN1ALDH1A1MAPTKDM4E
SCHEMBL1714052 0.81 PTGDR2 (0.68) PTGDR2ALDH1A1MAPTTDP1KDM4E
SCHEMBL2559901 0.80 ALDH1A1 (0.56) PTGDR2ERN1ALDH1A1MAPTTDP1
SCHEMBL15332229 0.79 KDM4E (0.58) PTGDR2ERN1ALDH1A1MAPTKDM4E

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 5 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