SCHEMBL8437618

SCHEMBL8437618

c1ccc(CC2Cc3occc3CN2)cc1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
POLB P06746 1/20 0.41
PNMT P11086 2/20 0.38

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
SCHEMBL4768294 0.85 MEN1 (0.46) MEN1KMT2APOLB
SCHEMBL3124097 0.77 PNMT (0.62) MEN1KMT2APOLBPNMT
SCHEMBL3119006 0.72 MEN1 (0.50) MEN1KMT2APOLBPNMT
SCHEMBL3127121 0.72 MEN1 (0.50) MEN1KMT2APOLBPNMT
SCHEMBL9350044 0.71 ADRB2 (0.50) MEN1KMT2APOLBPNMT
SCHEMBL8439222 0.71 MEN1 (0.40) MEN1KMT2APOLBPNMT
Hydrochloric Acid SCHEMBL8440099 0.70 MEN1 (0.42) MEN1KMT2APOLBPNMT
SCHEMBL3129776 0.69 PNMT (0.47) MEN1KMT2APOLBPNMT
SCHEMBL3127102 0.69 PNMT (0.47) MEN1KMT2APNMT
SCHEMBL1868363 0.68 PNMT (0.43) PNMT

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
US-5998433-A THERAPY FOR HYPERLIPIDEMIA; ATHEROSCLEROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-07 US disclosed
CN-1160403-A Substd. heterobicyclic alkyl amines and their use as squalene oxide cyclase inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-09-24 CN disclosed
EP-0785939-A1 SUBSTITUTED HETEROBICYCLIC ALKYL AMINES AND THEIR USE AS SQUALENE OXIDE CYCLASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 1997-07-30 EP disclosed
WO-1996011201-A1 SUBSTITUTED HETEROBICYCLIC ALKYL AMINES AND THEIR USE AS SQUALENE OXIDE CYCLASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-04-18 WO disclosed