SCHEMBL15330652

SCHEMBL15330652

CCc1ccc(-n2cc(C=O)c(C(=O)O)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.42
NPC1 O15118 8/20 0.42
SMN1; SMN2 Q16637 7/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 7/20 0.42
PTGS2 P35354 2/20 0.41
KDM4E B2RXH2 3/20 0.40
GLA P06280 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 2/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38

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
SCHEMBL2562063 0.84 ALDH1A1 (0.48) RAB9ANPC1SMN1; SMN2ALDH1A1PTGS2
SCHEMBL2562378 0.83 PTGES (0.48) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL29953592 0.82 PTGS2 (0.59) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL2560074 0.81 KMT2A (0.56) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL2558113 0.81 KDM4E (0.49) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL2558976 0.81 PTGS2 (0.60) RAB9ASMN1; SMN2MAPTALDH1A1PTGS2
SCHEMBL2555928 0.81 MEN1 (0.59) RAB9ANPC1MAPTLMNAALDH1A1
SCHEMBL2561958 0.81 PTGS2 (0.41) RAB9ASMN1; SMN2LMNAALDH1A1PTGS2
SCHEMBL2560956 0.78 ALDH1A1 (0.51) RAB9ANPC1SMN1; SMN2LMNAALDH1A1
SCHEMBL20142902 0.76 NPC1 (0.70) RAB9ANPC1SMN1; SMN2MAPTLMNA

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