SCHEMBL4084451

SCHEMBL4084451

CC1=C(C)N(Cc2ccccc2)[CH]N1Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.45
POLB P06746 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
ELANE P08246 2/20 0.43
F2 P00734 1/20 0.43
PLG P00747 1/20 0.43
CTSG P08311 1/20 0.43
CMA1 P23946 1/20 0.43
CTRC Q99895 1/20 0.43
TSHR P16473 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MC4R P32245 1/20 0.42
CYP19A1 P11511 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TP53 P04637 1/20 0.40
TNF P01375 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 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
SCHEMBL24701942 0.76 LMNA (0.39) LMNAPOLBSIGMAR1ELANEF2
SCHEMBL4084447 0.74 LMNA (0.48) LMNAPOLBSIGMAR1NPSR1ALDH1A1
SCHEMBL27586740 0.74 NSD2 (0.40) LMNASIGMAR1ELANEF2PLG
Hydrochloric Acid SCHEMBL4081730 0.73 LMNA (0.47) LMNAPOLBSIGMAR1NPSR1KDM4E
SCHEMBL28946773 0.71 POLB (0.50) LMNAPOLBSIGMAR1ELANEF2
SCHEMBL1078286 0.70 SIGMAR1 (0.48) LMNASIGMAR1ELANEF2PLG
SCHEMBL14812572 0.70 ELANE (0.42) LMNAPOLBSIGMAR1ELANEF2
SCHEMBL29272014 0.70 MC4R (0.41) LMNAPOLBSIGMAR1ELANEF2
SCHEMBL4308587 0.69 LMNA (0.39) LMNAPOLBSIGMAR1ELANEF2
SCHEMBL14837485 0.69 CYP19A1 (0.44) LMNAPOLBKDM4EALDH1A1CYP19A1

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