SCHEMBL9060967

SCHEMBL9060967

CNc1c(C#N)c(C)cc2c1C(=O)OC2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 11/20 0.37
▸ UPP1 Q16831 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ALDH1A1 P00352 5/20 0.33
▸ HPGD P15428 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ APOBEC3G Q9HC16 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ KLK7 P49862 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL9060829 0.78 KDM4E (0.39) KDM4EUPP1RECQLTDP1ALDH1A1
SCHEMBL9060665 0.69 PDE9A (0.41) KDM4EALDH1A1HPGDLMNAGAA
SCHEMBL9617574 0.68 ALOX15 (0.30) TDP1ALOX15
SCHEMBL1298310 0.68 ALOX15 (0.48) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL11348610 0.65 ALOX15 (0.37) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL29470963 0.65 ALOX15 (0.37) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL28729858 0.64 ALOX15 (0.43) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL29518416 0.64 ALOX15 (0.43) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL23665376 0.63 ALOX15 (0.39) KDM4ETDP1ALDH1A1HPGDALOX15
SCHEMBL4117969 0.63 TDP1 (0.39) KDM4ERECQLTDP1ALDH1A1HPGD

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5576398-A POLYCARBODIIMIDES GRAFTED WITH CARBOXYLIC ANHYDRIDE AND EPOXY COMPOUND FOR MOLDING MATERIALS JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1996-11-19 — — US disclosed
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