SCHEMBL15329600

SCHEMBL15329600

O=Cc1c[nH]c(-c2ccc(F)c(Cl)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.43
ERCC4 Q92889 1/20 0.43
KMO O15229 2/20 0.41
NISCH Q9Y2I1 1/20 0.39
CASP1 P29466 1/20 0.38
ABL1 P00519 1/20 0.38
ICMT O60725 1/20 0.37
HSD17B14 Q9BPX1 1/20 0.36
PTGS2 P35354 6/20 0.35
PTGS1 P23219 3/20 0.35
TDP2 O95551 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA1 P30542 1/20 0.35
RPA1 P27694 1/20 0.35
PGR P06401 2/20 0.34
EPHB4 P54760 1/20 0.34
NR3C1 P04150 1/20 0.34
NR3C2 P08235 1/20 0.34
AR P10275 1/20 0.34

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
SCHEMBL15331416 0.88 KMO (0.41) ERCC1ERCC4KMOABL1PTGS2
SCHEMBL2555372 0.86 TYMP (0.41) KMO
SCHEMBL2552851 0.86 TYMP (0.41) KMO
SCHEMBL2557559 0.82 PARP1 (0.36)
SCHEMBL15332262 0.82 DAPK3 (0.38) PTGS2PTGS1
SCHEMBL2555001 0.81 KDM4E (0.41) PTGS2
SCHEMBL2558891 0.79 ESR1 (0.45) HSD17B14
SCHEMBL2560329 0.79 ERN1 (0.43) KMONISCHPTGS2
SCHEMBL2563031 0.79 LRRK2 (0.39) PGR
SCHEMBL15331036 0.79 GAA (0.46)

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