SCHEMBL2558503

SCHEMBL2558503

O=CCSc1nccc(O)n1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
KMT2A Q03164 1/20 0.38
POLB P06746 2/20 0.36
HPGD P15428 3/20 0.35
ALDH1A1 P00352 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.34
DUSP10 Q9Y6W6 2/20 0.33
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPC1 O15118 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL8194267 0.82 GAA (0.49) ALOX15KMT2APOLBHPGDALDH1A1
SCHEMBL2558499 0.79 ALOX15 (0.58) ALOX15KMT2APOLBALDH1A1RAB9A
SCHEMBL6135340 0.76 HPGD (0.40) ALOX15KMT2AHPGDALDH1A1NPSR1
SCHEMBL16920976 0.76 SMN1; SMN2 (0.55) KMT2APOLBHPGDALDH1A1L3MBTL1
SCHEMBL6087618 0.75 ALOX15 (0.68) ALOX15KMT2APOLBHPGDALDH1A1
SCHEMBL29955418 0.74 HSD17B10 (0.43) KMT2AHPGDALDH1A1NPSR1L3MBTL1
SCHEMBL16920959 0.70 HSD17B10 (0.65) ALOX15KMT2APOLBHPGDALDH1A1
SCHEMBL13058926 0.70 NPSR1 (0.47) POLBHPGDALDH1A1NPSR1L3MBTL1
SCHEMBL5928189 0.70 ALDH1A1 (0.33) ALOX15KMT2APOLBHPGDALDH1A1
SCHEMBL16920981 0.69 ALDH1A1 (0.47) POLBHPGDALDH1A1L3MBTL1GAA

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