SCHEMBL8964423

SCHEMBL8964423

COc1cccc(CCl)c1OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BCHE P06276 18/20 0.68
KDM4E B2RXH2 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55

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
SCHEMBL3243180 0.89 HTR1A (0.54) BCHEKDM4EL3MBTL1
SCHEMBL8032637 0.86 POLB (0.51) BCHEKDM4EL3MBTL1
SCHEMBL13888119 0.86 BCHE (0.69) BCHEKDM4EL3MBTL1MEN1KMT2A
SCHEMBL21300617 0.85 BCHE (0.67) BCHEKDM4EL3MBTL1
SCHEMBL9802381 0.84 BCHE (0.68) BCHEKDM4EL3MBTL1
SCHEMBL6035893 0.84 BCHE (0.68) BCHEKDM4EL3MBTL1MEN1KMT2A
SCHEMBL4107928 0.84 SCN9A (0.54) BCHEKDM4EL3MBTL1
SCHEMBL4101732 0.84 ABCB1 (0.56) BCHEKDM4EL3MBTL1MEN1KMT2A
SCHEMBL4098049 0.83 BCHE (0.49) BCHEKDM4EL3MBTL1
SCHEMBL3056582 0.82 BCHE (0.64) BCHEKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106478502-B 1,2,3, 4-tetrahydroisoquinoline derivatives, preparation method and application thereof 上海翰森生物医药科技有限公司 2021-04-27 CN disclosed
CN-107922340-B 1,2,3, 4-tetrahydroisoquinoline derivatives, preparation method and application thereof 上海翰森生物医药科技有限公司 2020-07-10 CN disclosed
CN-107922340-A 1,2,3,4 tetrahydro isoquinoline derivatives, its preparation method and application 上海翰森生物医药科技有限公司 2018-04-17 CN disclosed
WO-2017036318-A1 1,2,3,4-TETRAHYDROISOQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 上海翰森生物医药科技有限公司 2017-03-09 WO disclosed
CN-106478502-A 1,2,3,4- tetrahydro isoquinoline derivative, its preparation method and application 上海翰森生物医药科技有限公司 2017-03-08 CN disclosed
US-5525614-A TREATING VASCULAR RESTENOSIS, CNS DISORDERS WARNER-LAMBERT COMPANY (US) 1996-06-11 US disclosed
US-5489686-A CARDIOVASCULAR DISORDER, NERVOUS SYSTEM DISORDER, ANTIDIURETIC , PSYCHLOGICAL DISORDER, ANTIDEPRESSANTS WARNER-LAMBERT COMPANY (US) 1996-02-06 US disclosed
EP-0641326-A1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINES WITH ANGIOTENSIN II RECEPTOR ANTAGONIST PROPERTIES WARNER-LAMBERT COMPANY (US) 1995-03-08 EP disclosed
US-5350757-A Treatment of vascular restenosis, nervous system disorders and cognition enhancement WARNER-LAMBERT COMPANY (US) 1994-09-27 US disclosed
WO-1993023378-A1 SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINES WITH ANGIOTENSIN II RECEPTOR ANTAGONIST PROPERTIES WARNER-LAMBERT COMPANY (US) 1993-11-25 WO disclosed
US-5246943-A Substituted 1,2,3,4-tetahydroisoquinolines with angiotensin II receptor antagonist properties WARNER-LAMBERT COMPANY (US) 1993-09-21 US disclosed