SCHEMBL317303

SCHEMBL317303

CCCC(O)c1cc[c]cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
RIPK1 Q13546 1/20 0.38
AOC3 Q16853 3/20 0.35
KDM4E B2RXH2 3/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
HTR1A P08908 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NMUR2 Q9GZQ4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CYP2C9 P11712 1/20 0.31
HIF1A Q16665 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31

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
SCHEMBL22399245 1.00 LMNA (0.40) LMNARIPK1AOC3KDM4EPDE4A
SCHEMBL317461 0.89 KDM4E (0.42) LMNARIPK1KDM4EALDH1A1S1PR2
SCHEMBL317890 0.88 S1PR2 (0.41) LMNARIPK1KDM4EALDH1A1SMN1; SMN2
SCHEMBL317513 0.86 S1PR2 (0.43) LMNAKDM4EALDH1A1S1PR2S1PR1
SCHEMBL21633858 0.84 LMNA (0.48) LMNARIPK1AOC3KDM4EPDE4A
SCHEMBL317586 0.82 LMNA (0.60) LMNARIPK1AOC3KDM4EALDH1A1
SCHEMBL6274882 0.80 RIPK1 (0.35) LMNARIPK1KDM4ETDP1HIF1A
SCHEMBL21750404 0.78 TAAR1 (0.39) LMNARIPK1AOC3KDM4EBLM
SCHEMBL29191773 0.78 RIPK1 (0.34) LMNARIPK1KDM4EHIF1ATAAR1
SCHEMBL8514307 0.78 HTR2A (0.42) LMNARIPK1AOC3CHRM2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365485-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2016-06-14 US claimed
US-20140323510-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2014-10-30 US claimed
US-8722726-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2014-05-13 US claimed
EP-2118094-B1 GAMMA-LACTAMS FOR THE TREATMENT OF GLAUCOMA OR ELEVATED INTRAOCULAR PRESSURE ALLERGAN INC (US) 2013-04-17 EP claimed
EP-2257548-B1 THERAPEUTIC COMPOUNDS ALLERGAN INC (US) 2012-12-26 EP claimed
US-7956051-B2 Therapeutic amides and related compounds ALLERGAN, INC. (US) 2011-06-07 US claimed
EP-2247583-A1 HYDRAZINES IN GLAUCOMA THERAPY ALLERGAN, INC. (US) 2010-11-10 EP claimed
US-20100137347-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2010-06-03 US claimed
EP-2121609-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS Allergan, Inc. (US) 2009-11-25 EP claimed
WO-2009094286-A1 HYDRAZINES IN GLAUCOMA THERAPY ALLERGAN, INC. (US) 2009-07-30 WO claimed
US-20090192151-A1 THERAPEUTIC AMIDES AND RELATED COMPOUNDS ALLERGAN, INC. 2009-07-30 US claimed
WO-2008091818-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2008-07-31 WO claimed
CN-1312229-C Process for producing chemically treated fillers PPG IND OHIO INC (US) 2007-04-25 CN claimed
CN-1312228-C Process for producing chemically modified fillers PPG IND OHIO INC (US) 2007-04-25 CN claimed
CN-1374988-A Process for producing chemically modified fillers PPG IND OHIO INC (US) 2002-10-16 CN claimed
CN-1374989-A Process for producing chemically treated fillers PPG IND OHIO INC (US) 2002-10-16 CN claimed
US-9796696-B2 Substituted arylcyclopentenes as therapeutic agents ALLERGAN, INC. (US) 2017-10-24 US disclosed
EP-2027081-B1 THERAPEUTIC PROSTAGLANDIN COMPOUNDS FOR THE TREATMENT OF GLAUCOMA ALLERGAN INC (US) 2017-05-03 EP disclosed
CN-1374988-A Process for producing chemically modified fillers PPG IND OHIO INC (US) 2002-10-16 CN disclosed
CN-1374987-A Process for producing hydrophobic particulate inorganic oxides PPG IND OHIO INC (US) 2002-10-16 CN 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 (3 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-20140323510-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ABCB1, THPO, UGT2B7 LMNA 3131/4885RIPK1 4834/4885AOC3 962/4885
US-20090192151-A1 THERAPEUTIC AMIDES AND RELATED COMPOUNDS VIP, SHH, GLI1 LMNA 3937/4885RIPK1 3019/4885AOC3 1947/4885
US-20100137347-A1 SUBSTITUTED ARYLCYCLOPENTENES AS THERAPEUTIC AGENTS ABCB1, THPO, UGT2B7 LMNA 2522/4885RIPK1 4840/4885AOC3 442/4885

“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.