SCHEMBL2562840

SCHEMBL2562840

Cc1ccc(-c2ccc(C=O)s2)c(C(=O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.44
PRF1 P14222 1/20 0.40
CYP2A6 P11509 2/20 0.40
NOTUM Q6P988 3/20 0.38
POLB P06746 2/20 0.38
PGR P06401 1/20 0.37
EIF4E P06730 1/20 0.36
DPP4 P27487 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2E1 P05181 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2B6 P20813 1/20 0.35

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
SCHEMBL2561442 0.82 KEAP1 (0.42) PRF1CYP2A6DPP4KDM4EHPGD
SCHEMBL2554875 0.82 SMN1; SMN2 (0.55) NOTUMPOLBKDM4EMAPTHPGD
SCHEMBL2558619 0.78 KDM4E (0.46) CYP2A6POLBDPP4KDM4EGAA
SCHEMBL2561507 0.77 POLB (0.51) CYP2A6POLBDPP4KDM4EGAA
SCHEMBL2557907 0.77 ESR2 (0.42) POLBKDM4EGAAHPGDALDH1A1
SCHEMBL2560754 0.77 EIF4E (0.46) CSNK2A1CYP2A6NOTUMPOLBPGR
SCHEMBL4621112 0.75 CSNK2A1 (0.65) CSNK2A1NOTUMPOLBHDAC7KDM4E
SCHEMBL15893301 0.75 ACHE (0.42) PRF1CYP2A6POLBPGRDPP4
SCHEMBL2555299 0.74 CYP2E1 (0.39) PRF1CYP2A6POLBPGRDPP4
SCHEMBL2554550 0.74 GABRP (0.42) PRF1CYP2A6POLBPGRDPP4

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