SCHEMBL3364531

SCHEMBL3364531

CC(OC=O)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
ALDH1A3 P47895 1/20 0.39
GAA P10253 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39
CYP2C19 P33261 1/20 0.39
POLB P06746 2/20 0.38
KMT2A Q03164 3/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
CA4 P22748 1/20 0.36
CHRNB4 P30926 2/20 0.35
CHRNA3 P32297 2/20 0.35
ADRA2A P08913 1/20 0.35

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
SCHEMBL10063722 0.89 ALDH1A3 (0.48) ALDH1A3GAACYP1A2CYP2C9PKM
SCHEMBL29191681 0.82 ALDH1A3 (0.52) MTNR1AMTNR1BALDH1A3GAACYP1A2
SCHEMBL352588 0.81 KDM4E (0.42) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL542873 0.79 KDM4E (0.50) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL3104291 0.79 KDM4E (0.41) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL7218355 0.77 TSHR (0.42) KDM4EALDH1A3POLBLMNAALDH1A1
SCHEMBL8963296 0.76 KDM4E (0.39) KDM4EMTNR1AMTNR1BGAACYP1A2
SCHEMBL11685923 0.76 KDM4E (0.59) KDM4EPKMALDH1A1HPGDMAOB
SCHEMBL4739378 0.76 MTNR1A (0.45) MTNR1AMTNR1BGAACYP1A2CYP2C9
Bicarbonate SCHEMBL3270191 0.76 GAA (0.52) KDM4EMTNR1AMTNR1BGAACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115704995-A Curable composition, cured film and application thereof, method for producing cured film, and polymer JSR株式会社 2023-02-17 CN disclosed
CN-115433591-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, polymer and method for producing same JSR株式会社 2022-12-06 CN disclosed
CN-115197719-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal element, and method for producing same JSR株式会社 2022-10-18 CN disclosed
CN-106047371-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal element JSR株式会社 2020-04-21 CN disclosed
EP-1164434-B1 Radiation-sensitive resin composition JSR CORP (JP) 2010-10-06 EP disclosed
EP-0977548-B2 FRAGRANCE PRO-ACCORDS PROCTER & GAMBLE (US) 2008-03-26 EP disclosed
EP-1221440-B1 Benzoheterocyclic derivatives useful as vasopressin or oxytocin modulators OTSUKA PHARMA CO LTD (JP) 2007-04-25 EP disclosed
EP-1085379-B1 Radiation-sensitive resin composition JSR CORP (JP) 2006-01-04 EP disclosed
US-6964840-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-11-15 US disclosed
US-20040241580-A1 Radiation-sensitive resin composition NISHIMURA YUKIO (JP) 2004-12-02 US disclosed
EP-0977549-A1 PERFUMES HAVING ODOR LONGEVITY BENEFITS THE PROCTER & GAMBLE COMPANY (US) 2000-02-09 EP disclosed
EP-0977548-A1 FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 2000-02-09 EP disclosed
US-6013618-A ORTHOESTERS, KETALS, ACETALS, ORTHOCARBONATES WHICH RELEASE TWO OR MORE FRAGRANCE RAW MATERIALS UPON HYDROLYSIS PROCTER & GAMBLE COMPANY (US) 2000-01-11 US disclosed
WO-1999043639-A1 TERTIARY ALCOHOL FRAGRANCE RAW MATERIAL DELIVERY SYSTEM THE PROCTER & GAMBLE COMPANY (US) 1999-09-02 WO disclosed
US-5919752-A ORTHOESTERS, KETALS, ACETALS, ORTHOCARBONATES WHICH RELEASE TWO OR MORE FRAGRANCE RAW MATERIALS UPON HYDROLYSIS. PROCTER & GAMBLE (US) 1999-07-06 US disclosed
WO-1998047478-A1 PERFUMES HAVING ODOR LONGEVITY BENEFITS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO disclosed
WO-1998047996-A1 LAUNDRY DETERGENT COMPOSITIONS COMPRISING FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO disclosed
WO-1998047477-A1 FRAGRANCE PRO-ACCORDS THE PROCTER & GAMBLE COMPANY (US) 1998-10-29 WO disclosed
EP-0765314-A1 BENZOHETEROCYCLIC DERIVATIVES USEFUL AS VASOPRESSIN OR OXYTOCIN MODULATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-04-02 EP disclosed
WO-1995034540-A1 BENZOHETEROCYCLIC DERIVATIVES USEFUL AS VASOPRESSIN OR OXYTOCIN MODULATORS OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-12-21 WO disclosed