SCHEMBL15330698

SCHEMBL15330698

Cc1c(F)cccc1-c1nc(C=O)c[nH]1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
AR P10275 2/20 0.34
PARP1 P09874 1/20 0.34
LRRK2 Q5S007 2/20 0.32
ABL1 P00519 1/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
CCNE2 O96020 1/20 0.32
CCNE1 P24864 1/20 0.32
CDK2 P24941 1/20 0.32
F2 P00734 1/20 0.31
DCUN1D1 Q96GG9 1/20 0.30
SLC9A1 P19634 1/20 0.30
ERN1 O75460 1/20 0.30

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
SCHEMBL2560940 0.85 CCNE2 (0.41) MGAMGAASIMGAM2PARP1
SCHEMBL2555128 0.85 TRIM24 (0.37) MGAMGAASIMGAM2PARP1
SCHEMBL3699501 0.84 DCUN1D1 (0.44) MGAMGAASIMGAM2PARP1
SCHEMBL2557341 0.82 ERN1 (0.44) ARPARP1CCNE2CCNE1CDK2
SCHEMBL15329991 0.80 ERN1 (0.34) PARP1JAK2JAK3ERN1
SCHEMBL15330457 0.78 NISCH (0.40) GAASLC9A1
SCHEMBL2557499 0.77 KMO (0.38) JAK2JAK3
SCHEMBL2558813 0.76 ERN1 (0.45) GAALRRK2DCUN1D1ERN1
SCHEMBL15331539 0.75 LRRK2 (0.35) LRRK2SLC9A1
SCHEMBL2560000 0.75 AR (0.33) AR

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