SCHEMBL1145324

SCHEMBL1145324

CCCCCC(O)c1[c]cccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.41
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PPARG P37231 4/20 0.35
ASAH1 Q13510 1/20 0.35
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
LMNA P02545 2/20 0.34
NAAA Q02083 2/20 0.33
PPARA Q07869 2/20 0.33
PDE5A O76074 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL3584428 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3587334 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3590952 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3594986 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3589049 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3582718 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3594352 0.98 CSNK1E (0.43) CSNK1ECNR2ALDH1A1PPARGASAH1
SCHEMBL3585938 0.95 ALDH1A1 (0.40) CSNK1ECNR2ALDH1A1KDM4EASAH1
SCHEMBL158756 0.89 LMNA (0.36) ALDH1A1KDM4ELMNA
SCHEMBL982653 0.84 NR1I2 (0.37) CSNK1ECNR2ALDH1A1PRSS1PRSS2

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121672-B1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN INC (US) 2014-12-10 EP disclosed
EP-1996546-B1 SUBSTITUTED GAMMA LACTAMS AS PROSTAGLANDIN EP2 AGONISTS ALLERGAN INC (US) 2014-11-26 EP disclosed
US-8420628-B2 Substituted beta-lactams ALLERGAN, INC. (US) 2013-04-16 US disclosed
EP-2041128-B1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN INC (US) 2012-08-08 EP disclosed
US-8202855-B2 Substituted beta-lactams ALLERGAN, INC (US) 2012-06-19 US disclosed
US-20110275692-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2011-11-10 US disclosed
EP-1877050-B1 SUBSTITUTED BETA-LACTAMS AND THEIR USE IN MEDICINE ALLERGAN INC (US) 2011-07-06 EP disclosed
US-7973071-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2011-07-05 US disclosed
US-7960381-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2011-06-14 US disclosed
US-7956055-B2 Substituted gamma lactams as therapeutic agents ALLERGAN, INC. (US) 2011-06-07 US disclosed
US-20070265330-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS OLD DAVID W 2007-11-15 US disclosed
WO-2007109578-A2 SUBSTITUTED GAMMA LACTAMS AS PROSTAGLANDIN EP2 AGONISTS ALLERGAN, INC. (US) 2007-09-27 WO disclosed
US-20070219265-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2007-09-20 US disclosed
WO-2006121708-A1 SUBSTITUTED BETA-LACTAMS AND THEIR USE IN MEDICINE ALLERGAN, INC. (US) 2006-11-16 WO disclosed
WO-2006098918-A2 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2006-09-21 WO disclosed
US-20060019822-A1 Palladium catalyst composition JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2006-01-26 US disclosed
EP-1537913-A1 PALLADIUM CATALYST COMPOSITION Wako Pure Chemical Industies, Ltd. (JP) 2005-06-08 EP disclosed
WO-2004035703-A1 MELT-FLOW CONTROLLING METHOD FOR ELASTOMER BY UV IRRADIATION LG CABLE LTD. (KR) 2004-04-29 WO disclosed
US-5025028-A Asthma BOEHRINGER MANNHEIM GMBH (DE) 1991-06-18 US disclosed
US-4906666-A Hydroxamic acids and pharmaceutical compositions containing them, and anti-allergic use thereof BOEHRINGER MANNHEIM GMBH (DE) 1990-03-06 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 (4 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-20110275692-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB CSNK1E 170/4885CNR2 3100/4885ALDH1A1 1580/4885
US-20070265330-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB CSNK1E 170/4885CNR2 3100/4885ALDH1A1 1580/4885
US-20070219265-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB CSNK1E 115/4885CNR2 3368/4885ALDH1A1 1561/4885
US-20060019822-A1 Palladium catalyst composition ODC1, NUDC, ADH1C CSNK1E 3523/4885CNR2 449/4885ALDH1A1 244/4885

“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.