SCHEMBL24282988

SCHEMBL24282988

Cc1ccccc1-c1cccc2c3ccccc3n(-c3cccc4c3C(=O)N(c3ccc(-c5ccccc5)cc3)C4O)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ RAB9A P51151 5/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ NPC1 O15118 3/20 0.36
▸ TP53 P04637 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ TYMS P04818 1/20 0.35
▸ PDE6D O43924 1/20 0.35
▸ DUSP3 P51452 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ PKM P14618 2/20 0.33
▸ STAT3 P40763 1/20 0.33
▸ STAT1 P42224 1/20 0.33
▸ EDNRB P24530 1/20 0.32

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
SCHEMBL19850027 0.90 MEN1 (0.46) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24282992 0.90 MEN1 (0.43) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24282872 0.90 MEN1 (0.38) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24282771 0.87 RAB9A (0.38) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24282769 0.86 RAB9A (0.37) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL23516303 0.86 RAB9A (0.37) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24283270 0.84 MEN1 (0.39) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL19850025 0.84 KMT2A (0.40) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL24283300 0.83 RAB9A (0.38) KMT2AMEN1ATMRAB9AALDH1A1
SCHEMBL23516159 0.83 RAB9A (0.37) KMT2AMEN1ATMRAB9AALDH1A1

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-3494112-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2022-04-20 — — EP disclosed
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