SCHEMBL23487274

SCHEMBL23487274

Brc1cc2c3sc4cccc5c6ccccc6c6ccccc6n(c2c2ccccc12)c3c45

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
PTPN1 P18031 1/20 0.32
HKDC1 Q2TB90 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
SCHEMBL23487271 0.86 PTPN1 (0.32) PTPN1HKDC1
SCHEMBL23487255 0.82 GPR3 (0.33) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL23486945 0.77 HKDC1 (0.32) PTPN1HKDC1
SCHEMBL21454079 0.76 GPR3 (0.40) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL26261208 0.75 KDM4E (0.45) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL21453477 0.75 GPR3 (0.41) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL23487218 0.74 MAPT (0.36) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL21453478 0.74 GPR3 (0.39) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL26528536 0.73 KDM4E (0.39) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL19890696 0.73 GPR3 (0.42) KDM4EMEN1ALDH1A1POLBMAPT

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-2021112478-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-06-10 WO disclosed