SCHEMBL4076507

SCHEMBL4076507

CC1=C(C)N(Cc2ccccc2)C(C)N1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.47
ACHE P22303 1/20 0.46
LMNA P02545 3/20 0.42
POLB P06746 1/20 0.42
SMO Q99835 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
BRD4 O60885 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
ALOX12 P18054 1/20 0.41
MAPK1 P28482 1/20 0.41
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
Hydrochloric Acid SCHEMBL4253880 0.98 EHMT2 (0.46) EHMT2ACHELMNAPOLBSMO
SCHEMBL18844475 0.83 BRD4 (0.53) EHMT2ACHELMNASMOBRD4
Hydrochloric Acid SCHEMBL28802075 0.81 SIGMAR1 (0.58) LMNAMEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL28330649 0.79 EHMT2 (0.44) EHMT2ACHELMNASMOMEN1
SCHEMBL13889204 0.75 CHRM2 (0.50) EHMT2ACHELMNAPOLBMEN1
SCHEMBL13317117 0.71 ACHE (0.44) EHMT2ACHELMNAPOLBMEN1
SCHEMBL15202275 0.71 ACHE (0.47) EHMT2ACHELMNAPOLBMEN1
SCHEMBL1078734 0.71 ACHE (0.47) EHMT2ACHELMNAPOLBMEN1
SCHEMBL18789346 0.71 EHMT2 (0.41) EHMT2ACHELMNASMOBRD4
SCHEMBL12855709 0.70 CHRM2 (0.50) EHMT2ACHELMNAPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1536787-A4 IMIDAZOLE ALKALOIDS FROM LEPIDIUM MEYENII AND METHODS OF USAGE PURE WORLD BOTAN INC (US) 2009-02-25 EP disclosed
EP-1536787-A2 IMIDAZOLE ALKALOIDS FROM LEPIDIUM MEYENII AND METHODS OF USAGE Pure World Botanicals, Inc. (US) 2005-06-08 EP disclosed
WO-2004016216-A3 IMIDAZOLE ALKALOIDS FROM LEPIDIUM MEYENII AND METHODS OF USAGE PURE WORLD BOTAN INC (US) 2004-04-29 WO disclosed
WO-2004016216-A2 IMIDAZOLE ALKALOIDS FROM LEPIDIUM MEYENII AND METHODS OF USAGE PURE WORLD BOTANICALS, INC. (US) 2004-02-26 WO disclosed