SCHEMBL11280436

SCHEMBL11280436

CCOc1cc(N2C(=O)/C(=C/N(C)C)N(C)C2=O)ccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.42
▸ ALDH1A1 P00352 5/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ TDP1 Q9NUW8 3/20 0.42
▸ MAPT P10636 5/20 0.36
▸ BCL2A1 Q16548 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ RAB9A P51151 2/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ XBP1 P17861 1/20 0.32
▸ BRD4 O60885 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
SCHEMBL11280438 1.00 KMT2A (0.42) KMT2AALDH1A1MEN1TDP1MAPT
SCHEMBL11282746 0.83 BCL2A1 (0.52) KMT2AALDH1A1MEN1MAPTBCL2A1
SCHEMBL11282741 0.83 BCL2A1 (0.52) KMT2AALDH1A1MEN1MAPTBCL2A1
SCHEMBL11278342 0.77 KMT2A (0.38) KMT2AALDH1A1MEN1TDP1MAPT
SCHEMBL11278349 0.77 KMT2A (0.38) KMT2AALDH1A1MEN1TDP1MAPT
SCHEMBL11277409 0.76 MEN1 (0.51) KMT2AALDH1A1MEN1TDP1MAPT
SCHEMBL11277401 0.76 MEN1 (0.51) KMT2AALDH1A1MEN1TDP1MAPT
SCHEMBL11269792 0.75 NOX4 (0.51) KMT2AALDH1A1MEN1MAPTBCL2A1
SCHEMBL11269789 0.75 NOX4 (0.51) KMT2AALDH1A1MEN1MAPTBCL2A1
SCHEMBL11274058 0.72 ELANE (0.47) KMT2AALDH1A1MEN1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4345936-A Imidazoles, compositions and herbicidal method ELI LILLY AND COMPANY (US) 1982-08-24 — — US disclosed
US-4345935-A PREEMERGENT AND POSTEMERGENT APPLICATION ELI LILLY AND COMPANY (US) 1982-08-24 — — US disclosed
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