SCHEMBL15330641

SCHEMBL15330641

CC(=O)Cc1c(C(=O)O)c(C)nn1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 1.00
CYP1A2 P05177 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
PDE4D Q08499 1/20 0.51
RAB9A P51151 5/20 0.48
HPGD P15428 3/20 0.48
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
NPC1 O15118 4/20 0.46
ABCB1 P08183 1/20 0.46
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL2938583 0.78 MEN1 (0.69) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL8090996 0.76 CYP1A2 (0.67) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL8084827 0.75 CYP1A2 (0.65) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL6681735 0.75 HPGD (0.69) POLBCYP1A2CYP2C9CYP2C19RAB9A
SCHEMBL5067031 0.75 HPGD (0.73) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL28786731 0.75 POLB (0.59) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL14132434 0.74 CYP2C9 (1.00) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL13013589 0.73 POLB (0.58) POLBCYP1A2CYP2C9CYP2C19RAB9A
SCHEMBL4130422 0.73 RAB9A (0.66) POLBCYP1A2CYP2C9CYP2C19PDE4D
SCHEMBL11476853 0.73 CYP1A2 (0.61) POLBCYP1A2CYP2C9CYP2C19PDE4D

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