SCHEMBL15330865

SCHEMBL15330865

COc1cccc(Cn2nc(C)c(C=O)c2Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 1/20 0.50
ALDH1A1 P00352 4/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 3/20 0.48
KDM4E B2RXH2 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
NR1H2 P55055 1/20 0.46
NR1H3 Q13133 1/20 0.46
SIGMAR1 Q99720 1/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
TP53 P04637 1/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 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
SCHEMBL964648 0.83 KMT2A (0.60) ALDH1A1MAPTLMNAKDM4ETDP1
SCHEMBL15329981 0.80 APLNR (0.46) ALDH1A1MAPTLMNAKDM4ETDP1
SCHEMBL15333494 0.77 KMT2A (0.46) ALDH1A1MAPTLMNAKDM4EL3MBTL1
SCHEMBL3320584 0.74 CMA1 (0.47) CMA1ALDH1A1MAPTLMNAKDM4E
SCHEMBL16832122 0.73 KDM4E (0.64) CMA1ALDH1A1MAPTKDM4ENR1H2
SCHEMBL16832460 0.71 GFER (0.63) CMA1ALDH1A1LMNAKDM4ETDP1
SCHEMBL3322315 0.70 HPGD (0.63) ALDH1A1MAPTLMNAKDM4ETDP1
SCHEMBL31019700 0.70 NPBWR1 (0.42) CMA1ALDH1A1MAPTLMNAKDM4E
SCHEMBL29951365 0.69 KMT2A (0.44) ALDH1A1MAPTLMNAKDM4ETDP1
SCHEMBL9055687 0.69 MEN1 (0.50) CMA1ALDH1A1LMNAKDM4ENR1H2

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