SCHEMBL2561371

SCHEMBL2561371

O=Cc1c[nH]c(-c2ccccc2C(=O)O)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.49
RAB9A P51151 3/20 0.49
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.41
ADORA2B P29275 1/20 0.40
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
CSNK2A1 P68400 1/20 0.39
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
MYC P01106 1/20 0.38
SOS1 Q07889 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX12 P18054 1/20 0.37
CSNK1A1 P48729 1/20 0.37
TYRO3 Q06418 1/20 0.37

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
SCHEMBL15330744 0.80 HTR2B (0.51) KDM4ERAB9APOLBHSD17B10NPC1
SCHEMBL15330563 0.78 C1R (0.36)
SCHEMBL15330942 0.76 ALDH1A1 (0.44) KDM4ERAB9AHSD17B10NPC1ALDH1A1
SCHEMBL2554044 0.76 ALDH1A1 (0.44) KDM4ERAB9ACSNK2A2CSNK2BNPC1
SCHEMBL474098 0.75 BTK (0.41) KDM4ERAB9APOLBNPC1SMN1; SMN2
SCHEMBL29953309 0.75 KDM4E (0.38) KDM4EALOX15CYP3A4ERN1
SCHEMBL15332409 0.73 DCUN1D1 (0.48) HSD17B10SMN1; SMN2ALDH1A1ALOX15ERN1
SCHEMBL15329526 0.73 PARP1 (0.40)
SCHEMBL15332078 0.73 TRPA1 (0.40) KDM4EALDH1A1
SCHEMBL29952752 0.73 IDO1 (0.39) KDM4ERAB9APOLBLMNAHSD17B10

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