SCHEMBL23729013

SCHEMBL23729013

Clc1cccc2c1c1ccc(Cl)c3c1n2c1cccc2c4ccccc4n3c21

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.32
FTO Q9C0B1 1/20 0.32
CYP1A2 P05177 3/20 0.31
CYP2A6 P11509 3/20 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
SCHEMBL23729052 0.91 KDM4E (0.44) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL25377981 0.86 HPGD (0.49) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL23723204 0.84 KDM4E (0.46) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL23723208 0.82 KDM4E (0.38) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL19387983 0.77 KDM4E (0.53) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL24034720 0.77 ALKBH5 (0.44) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL23728932 0.77 CYP2A6 (0.42) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL22954193 0.77 CYP1A2 (0.43) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL24034725 0.75 ALKBH5 (0.48) HPGDKDM4EMEN1ALDH1A1POLB
SCHEMBL15434837 0.75 ALKBH5 (0.48) HPGDKDM4EMEN1ALDH1A1POLB

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
WO-2021153931-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-08-05 WO disclosed