SCHEMBL4435324

SCHEMBL4435324

C[Si](C)(C)C#Cc1cccc(-c2cc(=O)n(CC3CC3)c3ccc(C(=O)c4ccc(Cl)cc4)cc23)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
ALK Q9UM73 1/20 0.34
FNTA P49354 3/20 0.33
FNTB P49356 3/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
NPC1 O15118 1/20 0.33
MDM2 Q00987 1/20 0.33
TACR1 P25103 1/20 0.33
RORC P51449 1/20 0.33
PTGER4 P35408 1/20 0.33

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
SCHEMBL4291529 0.86 FNTA (0.44) ALKFNTAFNTB
SCHEMBL6164984 0.85 BRD4 (0.44) BRD4CREBBPFNTAFNTBNPC1
SCHEMBL5722582 0.83 NPC1 (0.37) BRD4CREBBPFNTAFNTBNPC1
SCHEMBL5722543 0.77 FNTA (0.46) FNTAFNTBRORC
SCHEMBL2495670 0.75 MAPT (0.36) ALDH1A1LMNAHPGDALKFNTA
SCHEMBL27537216 0.75 ALK (0.33) ALKPTGESALOX5
SCHEMBL5722590 0.74 FNTA (0.41) ALDH1A1FNTAFNTB
SCHEMBL4301651 0.74 FNTA (0.36) ALKFNTAFNTB
SCHEMBL12590536 0.74 FNTA (0.42) BRD4CREBBPFNTAFNTB
SCHEMBL11947178 0.73 FNTA (0.43) FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1107963-B1 ALKYNYL-SUBSTITUTED QUINOLIN-2-ONE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2006-03-22 EP claimed
US-20020128287-A1 Alkynyl-substituted quinolin-2-one derivatives useful as anticancer agents LYSSIKATOS JOSEPH P (US) 2002-09-12 US claimed
EP-1107963-A1 ALKYNYL-SUBSTITUTED QUINOLIN-2-ONE DERIVATIVES USEFUL AS ANTICANCER AGENTS Pfizer Products Inc. (US) 2001-06-20 EP claimed
US-6150377-A Alkynyl-substituted quinolin-2-one derivatives useful as anticancer agents PFIZER INC. (US) 2000-11-21 US claimed
WO-2000012499-A1 ALKYNYL-SUBSTITUTED QUINOLIN-2-ONE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PRODUCTS INC. (US) 2000-03-09 WO claimed
US-8232402-B2 Quinolinone farnesyl transferase inhibitors for the treatment of synucleinopathies and other indications LINK MEDICINE CORPORATION (US) 2012-07-31 US disclosed
WO-2009151683-A2 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS LINK MEDICINE CORPORATION (US) 2009-12-17 WO disclosed
US-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS ASTRAZENECA AB (SE) 2009-10-08 US disclosed
EP-1107963-B1 ALKYNYL-SUBSTITUTED QUINOLIN-2-ONE DERIVATIVES USEFUL AS ANTICANCER AGENTS PFIZER PROD INC (US) 2006-03-22 EP disclosed
US-6579887-B2 Effective in inhibiting farnesyl protein transferase; also useful in treating benign proliferative disease. PFIZER INC 2003-06-17 US disclosed
US-20020128287-A1 Alkynyl-substituted quinolin-2-one derivatives useful as anticancer agents LYSSIKATOS JOSEPH P (US) 2002-09-12 US disclosed
US-6294552-B1 TREATMENT OF HYPERPROLIFERATIVE DISORDERS, SUCH AS CANCER, IN MAMMALS. THE INVENTION ALSO RELATES TO METHODS OF INHIBITING ABNORMAL CELL GROWTH, INCLUDING CANCER, IN A MAMMAL BY ADMINISTERING THE COMPOUNDS OF FORMULA 1 TO A MAMMAL REQUIRING PFIZER INC. 2001-09-25 US disclosed
US-6150377-A Alkynyl-substituted quinolin-2-one derivatives useful as anticancer agents PFIZER INC. (US) 2000-11-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090253655-A1 QUINOLINONE FARNESYL TRANSFERASE INHIBITORS FOR THE TREATMENT OF SYNUCLEINOPATHIES AND OTHER INDICATIONS PANK1, PANK3, PANK2 ALDH1A1 2151/4885LMNA 1232/4885HPGD 1359/4885
US-20020128287-A1 Alkynyl-substituted quinolin-2-one derivatives useful as anticancer agents CCNA1, NRAS, CCNT1 ALDH1A1 202/4885LMNA 928/4885HPGD 1590/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.