SCHEMBL23640676

SCHEMBL23640676

C=C/C=C\c1c(C)c2ccccc2n1Cc1ccc(C)c(N)c1C

nearest known ligand 0.32

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ KDM4A O75164 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ GLA P06280 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ SYK P43405 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ THRB P10828 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
SCHEMBL26032878 0.87 ALDH1A1 (0.34) ALDH1A1KMT2AMEN1USP2KDM4A
SCHEMBL21154987 0.79 CYP19A1 (0.44) ALDH1A1KMT2AMEN1USP2KDM4A
SCHEMBL22732753 0.71 CYP11B2 (0.31) —
SCHEMBL23986120 0.70 ALDH1A1 (0.47) ALDH1A1KDM4ALMNAHSD17B10RAB9A
SCHEMBL19154977 0.70 GPR3 (0.44) ALDH1A1KMT2AMEN1LMNAHSD17B10
SCHEMBL21779797 0.69 HTR6 (0.37) ALDH1A1KMT2AMEN1KDM4ALMNA
SCHEMBL19335792 0.69 NPSR1 (0.31) MAPTKDM4E
SCHEMBL26235006 0.69 GPR3 (0.31) LMNA
SCHEMBL16326732 0.68 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1LMNAHSD17B10
SCHEMBL25703752 0.67 HTR7 (0.51) —

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
EP-3663308-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND SAMSUNG ELECTRONICS CO LTD (KR) 2021-07-14 — — EP disclosed
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