SCHEMBL2558137

SCHEMBL2558137

CC(=O)c1ccc(-c2ccncc2C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
DHODH Q02127 1/20 0.43
EIF4E P06730 1/20 0.43
KDM4C Q9H3R0 2/20 0.42
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KDM6B O15054 1/20 0.42
KDM4A O75164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
THRB P10828 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4D Q6B0I6 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HSD17B1 P14061 2/20 0.42
SIRT3 Q9NTG7 1/20 0.41
CYP46A1 Q9Y6A2 1/20 0.41

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
SCHEMBL2553120 0.87 LTB4R2 (0.47) MAPTSMN1; SMN2DHODHEIF4EKDM4C
SCHEMBL6906435 0.83 ALDH1A1 (0.50) MAPTSMN1; SMN2DHODHEIF4EKDM4C
SCHEMBL30292657 0.83 ALDH1A1 (0.50) MAPTSMN1; SMN2DHODHEIF4EKDM4C
SCHEMBL30292662 0.83 ALDH1A1 (0.50) MAPTSMN1; SMN2DHODHEIF4EKDM4C
SCHEMBL2560779 0.82 DDT (0.51) EIF4EMKNK2KDM4EMEN1ALDH1A1
SCHEMBL2222831 0.81 ALDH1A1 (0.50) MAPTDHODHKDM4CTDP1KDM4E
SCHEMBL28879472 0.80 SLC22A12 (0.56) MAPTSMN1; SMN2KDM4EMEN1ALDH1A1
Hydrochloric Acid SCHEMBL7279409 0.80 ALDH1A1 (0.49) MAPTDHODHKDM4CTDP1KDM4E
SCHEMBL2883252 0.79 SMN1; SMN2 (0.62) MAPTSMN1; SMN2DHODHKDM4EALDH1A1
SCHEMBL27982333 0.79 ALDH1A1 (0.49) MAPTSMN1; SMN2DHODHKDM4CMKNK1

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