SCHEMBL29450666

SCHEMBL29450666

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc(-c5ccc(-c6ccccc6)cc5)ncn4)cc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ CYP1A2 P05177 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ PDK2 Q15119 5/20 0.36
▸ MIF P14174 1/20 0.36
▸ ASIC3 Q9UHC3 1/20 0.36
▸ ADK P55263 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ KMO O15229 1/20 0.34

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
SCHEMBL20137315 1.00 KMT2A (0.39) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL20149262 1.00 KMT2A (0.39) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL20137313 0.95 KMT2A (0.36) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL29450675 0.95 KMT2A (0.36) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL20137318 0.94 KMO (0.40) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL20149263 0.94 PDK2 (0.34) KMT2ASMN1; SMN2CYP1A2KDM4EMEN1
SCHEMBL24646366 0.88 PDK2 (0.46) KMT2ASMN1; SMN2MEN1MAPTPDK2
SCHEMBL17153663 0.88 PDK2 (0.46) KMT2ASMN1; SMN2MEN1MAPTPDK2
SCHEMBL16366431 0.88 PDK2 (0.46) KMT2ASMN1; SMN2MEN1MAPTPDK2
SCHEMBL24647433 0.88 PDK2 (0.46) KMT2ASMN1; SMN2MEN1MAPTPDK2

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
CN-114284447-A Organic compound, light-emitting element, and method for synthesizing organic compound 株式会社半导体能源研究所 2022-04-05 — — CN disclosed
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