SCHEMBL13837285

SCHEMBL13837285

COc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccc(Oc4ccc(C(=O)c5ccc(O)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ RAB9A P51151 4/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ MAPT P10636 1/20 0.53
▸ LTA4H P09960 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ ALOX5 P09917 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ SRD5A2 P31213 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.46
▸ POLB P06746 2/20 0.46
▸ CTDSP1 Q9GZU7 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ ACACB O00763 1/20 0.45
▸ ACACA Q13085 1/20 0.45
▸ NPC1 O15118 2/20 0.45
▸ BACE1 P56817 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HPGD P15428 2/20 0.45

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
SCHEMBL13837307 0.91 HSD17B2 (0.51) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL12252096 0.90 ALOX5 (0.47) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL4402837 0.88 HPGD (0.56) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL2623414 0.87 ALOX5 (0.50) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL12256026 0.87 ALOX5 (0.50) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL12012656 0.87 ALOX5 (0.50) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL14665302 0.86 CES2 (0.56) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL21507252 0.86 SRD5A2 (0.61) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL13628166 0.85 SRD5A2 (0.60) KMT2ARAB9AMEN1LMNAMAPT
SCHEMBL13837369 0.84 SRD5A2 (0.51) RAB9ALMNAMAPTALOX5SRD5A2

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
US-20120286653-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY DEVICE, AND ORGANIC EL ILLUMINATOR MITSUBISHI CHEMICAL CORPORATION (JP) 2012-11-15 — — US disclosed
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