SCHEMBL4743860

SCHEMBL4743860

O=C(O)CCC(=O)c1ccccn1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 10/20 0.63
WNT3A P56704 8/20 0.63
LMNA P02545 1/20 0.59
NAPRT Q6XQN6 1/20 0.59
P4HTM Q9NXG6 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CES2 O00748 1/20 0.55
CES1 P23141 1/20 0.55
NR4A2 P43354 1/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 3/20 0.52
GRM4 Q14833 1/20 0.50
GAA P10253 1/20 0.48
CYP2C19 P33261 1/20 0.48

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
SCHEMBL30609612 1.00 CTNNB1 (0.63) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL2470002 0.92 CTNNB1 (0.71) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL5849694 0.89 CTNNB1 (0.59) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL29884496 0.89 CTNNB1 (0.59) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL2418294 0.89 CTNNB1 (0.55) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL3380712 0.87 HDAC1 (0.58) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL9196964 0.87 CTNNB1 (0.68) CTNNB1WNT3ALMNANAPRTP4HTM
SCHEMBL15980176 0.85 CTNNB1 (0.65) CTNNB1WNT3ALMNANAPRTP4HTM
Succinic Acid SCHEMBL27770028 0.83 LMNA (0.57) CTNNB1WNT3ALMNANAPRTP4HTM
Succinic Acid SCHEMBL27770027 0.83 LMNA (0.57) CTNNB1WNT3ALMNANAPRTP4HTM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4156091-A 11-Deoxy-11-hydroxymethyl-6-hydroxy-PGE1 compounds THE UPJOHN COMPANY (US) 1979-05-22 US claimed
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis GALAPAGOS NV (BE) 2023-08-08 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed
US-20080200512-A1 Hepatitis C virus polymerase inhibitors BLANEY JEFFREY MARK 2008-08-21 US disclosed
WO-2008098859-A1 HCV POLYMERASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-08-21 WO disclosed
EP-0496555-B1 Corrosion-inhibiting coating compositions CIBA GEIGY AG (CH) 1997-11-19 EP disclosed
US-5277709-A Film forming binder and corrosion inhibitor CIBA-GEIGY CORPORATION (US) 1994-01-11 US disclosed
EP-0496555-A2 Corrosion-inhibiting coating compositions CIBA-GEIGY AG (CH) 1992-07-29 EP disclosed
US-4725580-A ARTERIAL TENSION SANOFI (FR) 1988-02-16 US disclosed
US-4342690-A HHYPOTENSIVE AGE TS AMERICAN CYANAMID COMPANY (US) 1982-08-03 US disclosed
US-4342689-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1982-08-03 US disclosed
US-4342691-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1982-08-03 US disclosed
US-4299769-A HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1981-11-10 US disclosed
US-4136184-A TRANQUILIZERS, ANTICONVULSANTS, MUSCLE RELAXANTS SANDOZ, INC. (US) 1979-01-23 US disclosed
US-4055644-A CNS DEPRESSANTS SANDOZ, INC. (US) 1977-10-25 US disclosed
US-3931176-A CNS DEPRESSANT SANDOZ INC. (US) 1976-01-06 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-20080200512-A1 Hepatitis C virus polymerase inhibitors SSU72, POLR2H, POLR2E CTNNB1 4645/4885WNT3A 4748/4885LMNA 3432/4885
US-11718588-B2 5-[(piperazin-1-yl)-3-oxo-propyl]-imidazolidine-2,4-dione derivatives as ADAMTS inhibitors for the treatment of osteoarthritis ADAMTS1, ADAMTS5, ADAMTS7 CTNNB1 1867/4885WNT3A 687/4885LMNA 868/4885

“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.