SCHEMBL21574929

SCHEMBL21574929

CC1(C)c2ccccc2-c2cc3c4ccccc4n(N)c3cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HBB P68871 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ GPR3 P46089 1/20 0.32
▸ PGR P06401 2/20 0.31
▸ MLNR O43193 1/20 0.31
▸ NR1I2 O75469 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ CHRM1 P11229 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
SCHEMBL25059079 0.94 MAPT (0.35) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL21973023 0.85 MAPT (0.35) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL12685731 0.84 GPR3 (0.48) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL18436299 0.82 MAPT (0.32) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL19147805 0.81 PGR (0.41) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL14822435 0.81 KDM4E (0.43) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL14849805 0.81 KDM4E (0.43) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL18518751 0.81 KDM4E (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL14849855 0.81 KDM4E (0.40) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL802718 0.81 KDM4E (0.43) MAPTKDM4EMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4137551-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-02-22 — — EP disclosed
EP-3995497-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE Canon Kabushiki Kaisha (JP) 2022-05-11 — — EP disclosed
EP-2976322-B1 SYNTHETIC BUILDING BLOCKS FOR THE PRODUCTION OF MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2019-11-20 — — EP disclosed
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