SCHEMBL8035903

SCHEMBL8035903

C=CCN(C)Cc1ccc(-c2ccc(C(=O)c3ccc(C#N)cc3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 10/20 0.71
▸ NSD2 O96028 1/20 0.50
▸ PYCR1 P32322 1/20 0.47
▸ SIGMAR1 Q99720 2/20 0.46
▸ TMEM97 Q5BJF2 1/20 0.46
▸ POLB P06746 1/20 0.43
▸ ACHE P22303 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ KMT2A Q03164 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 SCHEMBL9148408 0.99 LSS (0.72) LSSNSD2PYCR1SIGMAR1TMEM97
Hydrochloric Acid SCHEMBL9152624 0.83 LSS (0.79) LSSPYCR1ACHEMEN1KMT2A
SCHEMBL9150936 0.83 LSS (0.76) LSSPYCR1ACHE
SCHEMBL4314508 0.83 LSS (1.00) LSSPYCR1ACHEMEN1KMT2A
Hydrochloric Acid SCHEMBL9150554 0.82 LSS (0.77) LSSNSD2PYCR1ACHE
SCHEMBL14142956 0.80 LSS (0.71) LSSPYCR1ACHENPC1
SCHEMBL9151950 0.80 LSS (0.56) LSSNSD2MEN1KMT2A
SCHEMBL3675147 0.79 LSS (0.70) LSSPYCR1SIGMAR1TMEM97ACHE
Hydrochloric Acid SCHEMBL8049750 0.78 LSS (0.70) LSSPYCR1SIGMAR1TMEM97ACHE
Hydrochloric Acid SCHEMBL9147192 0.78 LSS (0.70) LSSPYCR1SIGMAR1TMEM97POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 — — EP claimed
US-5574071-A ADMINISTERING PHENYLALKYLAMINO KETONES HOFFMANN-LA ROCHE INC. (US) 1996-11-12 — — US claimed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 — — EP claimed
EP-0636367-B1 Use of phenylalkylamines for producing cholesterol lowering agents HOFFMANN LA ROCHE (CH) 2000-03-29 — — EP disclosed
US-5637771-A Compound useful for lowering cholesterol HOFFMANN-LA ROCHE INC. (US) 1997-06-10 — — US disclosed
US-5574071-A ADMINISTERING PHENYLALKYLAMINO KETONES HOFFMANN-LA ROCHE INC. (US) 1996-11-12 — — US disclosed
US-5495048-A ANTICHOLESTEROL AGENTS HOFFMANN-LA ROCHE INC. (US) 1996-02-27 — — US disclosed
EP-0636367-A1 Use of phenylalkylamines for producing cholesterol lowering agents F. HOFFMANN-LA ROCHE AG (CH) 1995-02-01 — — EP disclosed
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