SCHEMBL383349

SCHEMBL383349

COC(=O)c1ccccc1CCCO

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
LMNA P02545 2/20 0.66
DHODH Q02127 1/20 0.53
KDM4E B2RXH2 2/20 0.53
GLA P06280 1/20 0.53
CYP4A11 Q02928 3/20 0.51
TSHR P16473 1/20 0.50
HSD17B10 Q99714 2/20 0.49
CFTR P13569 1/20 0.49
HIF1A Q16665 1/20 0.48
KMT2A Q03164 1/20 0.47
POLB P06746 2/20 0.47
ATM Q13315 1/20 0.47
CYP4F2 P78329 2/20 0.46
SLC6A3 Q01959 3/20 0.45
SLC6A4 P31645 2/20 0.45
HTT P42858 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA5A P35218 1/20 0.44

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
SCHEMBL3554041 0.95 ALDH1A1 (0.64) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL5253878 0.93 ALDH1A1 (0.62) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL2655008 0.93 ALDH1A1 (0.62) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL2655484 0.89 ALDH1A1 (0.70) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL10360804 0.87 ALDH1A1 (0.77) ALDH1A1LMNAKDM4EGLATSHR
SCHEMBL1789262 0.86 ALDH1A1 (0.66) ALDH1A1LMNADHODHKDM4ETSHR
SCHEMBL385826 0.85 ALDH1A1 (0.64) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL5734169 0.85 ALDH1A1 (0.64) ALDH1A1LMNADHODHKDM4EGLA
SCHEMBL28106654 0.85 ALDH1A1 (0.64) ALDH1A1LMNADHODHTSHRHSD17B10
SCHEMBL6621914 0.85 ALDH1A1 (0.64) ALDH1A1LMNADHODHKDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110157251-B Curing agent composition and coating composition comprising same KCC公司 2022-04-01 CN disclosed
EP-2802557-B1 LEUKOTRIENE B4 ANTAGONIST COMPOUND LILLY CO ELI (US) 2016-04-06 EP disclosed
US-9187411-B2 Leukotriene B4 antagonist compound ELI LILLY AND COMPANY (US) 2015-11-17 US disclosed
US-20140343151-A1 LEUKOTRIENE B4 ANTAGONIST COMPOUND ELI LILLY AND COMPANY 2014-11-20 US disclosed
EP-2802557-A1 LEUKOTRIENE B4 ANTAGONIST COMPOUND Eli Lilly and Company (US) 2014-11-19 EP disclosed
WO-2013106238-A1 LEUKOTRIENE B4 ANTAGONIST COMPOUND ELI LILLY AND COMPANY (US) 2013-07-18 WO disclosed
US-8101625-B2 Pyrimidinones as Casein Kinase II (CK2) modulators EXELIXIS, INC. (US) 2012-01-24 US disclosed
EP-1948617-B1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS INC (US) 2011-07-27 EP disclosed
US-7858642-B2 Substituted hydroxyethylamine aspartyl protease inhibitors ELAN PHARMACEUTICALS, INC. (US) 2010-12-28 US disclosed
US-7858642-B2 Substituted hydroxyethylamine aspartyl protease inhibitors ELAN PHARMACEUTICALS, INC. (US) 2010-12-28 US disclosed
EP-1541559-A1 5-SUBSTITUTED ISOQUINOLINE DERIVATIVE Asahi Kasei Pharma Corporation (JP) 2005-06-15 EP disclosed
US-20050020623-A1 5-Substituted isoquinoline derivatives ASAHI KASEI PHARMA CORPORATION (JP) 2005-01-27 US disclosed
US-6133446-A Heterocyclic compounds for the treatment of CNS and cardiovascular disorders PHARMACIA & UPJOHN COMPANY (US) 2000-10-17 US disclosed
EP-0737189-B1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS UPJOHN CO (US) 1999-07-28 EP disclosed
US-5877317-A Heterocyclic compounds for the treatment of CNS and cardiovascular disorders PHARMACIA & UPJOHN COMPANY (US) 1999-03-02 US disclosed
CN-1145619-A Substituted pyridine leukotriene B4 antagonists HOFFMANN LA ROCHE (CH) 1997-03-19 CN disclosed
EP-0755381-A1 SUBSTITUTED PYRIDINE LEUKOTRIENE B 4 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1997-01-29 EP disclosed
EP-0737189-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS PHARMACIA & UPJOHN COMPANY (US) 1996-10-16 EP disclosed
WO-1995028386-A1 SUBSTITUTED PYRIDINE LEUKOTRIENE B4 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1995-10-26 WO disclosed
WO-1995018118-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CNS AND CARDIOVASCULAR DISORDERS THE UPJOHN COMPANY (US) 1995-07-06 WO 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-20140343151-A1 LEUKOTRIENE B4 ANTAGONIST COMPOUND LTB4R2, LTB4R, LTA4H ALDH1A1 2170/4885LMNA 755/4885DHODH 1047/4885
US-20050020623-A1 5-Substituted isoquinoline derivatives MYLK, MYLK2, MYL12A ALDH1A1 2534/4885LMNA 178/4885DHODH 4688/4885

“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.