SCHEMBL11439872

SCHEMBL11439872

Cc1nccn1CC=CCc1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.43
▸ LMNA P02545 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ BRD4 O60885 1/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL11147568 0.89 BTK (0.39) KCNH2LMNAL3MBTL1MEN1KMT2A
SCHEMBL11446079 0.84 KCNH2 (0.43) KCNH2LMNAL3MBTL1KMT2AALDH1A1
SCHEMBL11147256 0.75 LMNA (0.42) KCNH2LMNAL3MBTL1MEN1KMT2A
SCHEMBL11439870 0.74 KCNH2 (0.39) KCNH2LMNAL3MBTL1BRD4KMT2A
SCHEMBL2950629 0.73 LMNA (0.71) KCNH2LMNAL3MBTL1BRD4MEN1
SCHEMBL11150767 0.72 KMT2A (0.41) KCNH2LMNAL3MBTL1BRD4KMT2A
SCHEMBL11148693 0.72 KCNH2 (0.40) KCNH2LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL11148698 0.72 KCNH2 (0.40) KCNH2LMNAMEN1KMT2ASMN1; SMN2
SCHEMBL11148240 0.72 OPRD1 (0.42) LMNAL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL11149274 0.72 POLB (0.43) KCNH2LMNAL3MBTL1MEN1KMT2A

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-0009683-A1 Basic phenyl ethers, pharmaceutical compositions containing them and the preparation of these ethers and compositions MERCK PATENT GmbH (DE) 1980-04-16 — — EP disclosed
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