SCHEMBL2561144

SCHEMBL2561144

O=CCC(=O)c1ccc2c(c1)Cc1ccccc1-2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 2/20 0.62
KDM4E B2RXH2 5/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HTR2C P28335 2/20 0.54
HTR2B P41595 2/20 0.54
DRD2 P14416 1/20 0.54
ADRA1D P25100 1/20 0.54
HTR2A P28223 1/20 0.54
HTR7 P34969 1/20 0.54
ADRA1A P35348 1/20 0.54
ADRA1B P35368 1/20 0.54
MAPT P10636 7/20 0.49
ALDH1A1 P00352 4/20 0.49
KMT2A Q03164 3/20 0.49
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
POLB P06746 2/20 0.49
PPARG P37231 1/20 0.49

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
SCHEMBL8535923 0.83 SRD5A2 (0.69) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL28553894 0.83 SRD5A2 (0.56) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10994744 0.83 SRD5A2 (0.68) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL18222925 0.81 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL7786912 0.81 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10967373 0.81 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL10968921 0.81 SRD5A2 (0.66) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL25188173 0.80 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL11844589 0.80 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B
SCHEMBL27363308 0.80 SRD5A2 (0.64) SRD5A2KDM4EL3MBTL1HTR2CHTR2B

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