SCHEMBL3170733

SCHEMBL3170733

CCC(C)Oc1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.45
ESR1 P03372 3/20 0.45
MAPT P10636 2/20 0.45
PTGS1 P23219 2/20 0.45
SLC6A2 P23975 2/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
PGR P06401 1/20 0.45
CHRM2 P08172 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
AR P10275 1/20 0.45
CYP2D6 P10635 1/20 0.45
CHRM1 P11229 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX15 P16050 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45
CYP2C19 P33261 1/20 0.45
ADRA1A P35348 1/20 0.45

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
SCHEMBL122883 0.89 ACACB (0.45) LTA4HMAPTACACBKMT2AMTNR1A
SCHEMBL417296 0.88 PKM (0.59) MAPTLMNAACACBKMT2A
SCHEMBL2089562 0.83 LTA4H (0.44) LTA4HESR1MAPTPTGS1SLC6A2
SCHEMBL9265587 0.83 ACACB (0.43) LTA4HMAPTACACBKMT2AMTNR1A
SCHEMBL10638151 0.83 ESR2 (0.42) LTA4HESR1PTGS1SLC6A2NR5A1
SCHEMBL12521736 0.82 ALDH1A3 (0.48) MAPTLMNACYP1A2CYP2D6CYP2C19
SCHEMBL11432548 0.82 ADRB2 (0.46) ESR1MAPTSLC6A2LMNACYP1A2
SCHEMBL340041 0.82 HDAC1 (0.42) MAPTACACBMTNR1AMTNR1B
SCHEMBL10799462 0.81 MTNR1A (0.42) LTA4HESR1PTGS1SLC6A2ESR2
SCHEMBL9406472 0.80 LTA4H (0.44) LTA4HESR1MAPTPTGS1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103869623-B Coating composition 默克专利有限公司 2017-07-21 CN disclosed
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
CN-101522601-B Process for production of alcohol compound SUMITOMO CO LTD 2013-05-29 CN disclosed
EP-2036878-B1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND SUMITOMO CHEMICAL CO (JP) 2012-08-22 EP disclosed
US-20110234950-A1 COLOR FILTER AND ELECTRONIC DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed
US-7745669-B2 Process for production of alcohol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-29 US disclosed
US-7648811-B2 Branched polyarylene ethers and processes for the preparation thereof XEROX CORPORATION (US) 2010-01-19 US disclosed
US-20090259074-A1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-10-15 US disclosed
EP-1971665-B1 DENDRIMERIC FLUORESCENT COMPOUNDS AND USE OF SUCH COMPOUNDS IN MULTI-PHOTON DEVICES OR PROCESSES UNIV RENNES (FR) 2009-09-16 EP disclosed
CN-101522601-A Process for production of alcohol compound SUMITOMO CHEMICAL CO (JP) 2009-09-02 CN disclosed
EP-0353571-A1 Phenoxyalkyl-substituted heteroaromates, process for their preparation and their use as pesticides BASF Aktiengesellschaft (DE) 1990-02-07 EP disclosed
EP-0297554-A2 Liquid-crystalline polymer composition IDEMITSU KOSAN COMPANY LIMITED (JP) 1989-01-04 EP disclosed
EP-0258391-A1 USE OF HETEROCYCLIC NITROGEN-CONTAINING COMPOUNDS FOR REDUCING MOISTURE LOSS FROM PLANTS AND INCREASING CROP YIELD RHONE POULENC NEDERLAND B.V. (NL) 1988-03-09 EP disclosed
US-4697033-A INSECTICIDES SANDOZ LTD. (CH) 1987-09-29 US disclosed
WO-1987004321-A2 USE OF HETEROCYCLIC NITROGEN-CONTAINING COMPOUNDS FOR REDUCING MOISTURE LOSS FROM PLANTS AND INCREASING CROP YIELD RHONE-POULENC NEDERLANDS B.V. (NL) 1987-07-30 WO disclosed
US-4661617-A PESTICIDES SANDOZ LTD. (CH) 1987-04-28 US disclosed
US-4631252-A PHOTOGRAPHIC STABILIZERS CIBA-GEIGY AG (CH) 1986-12-23 US disclosed
US-4616082-A PHOTOGRAPHIC STABILIZERS CIBA-GEIGY AG (CH) 1986-10-07 US disclosed
US-4590282-A Pest control agents SANDOZ LTD. (CH) 1986-05-20 US disclosed
US-4549015-A PHOTOHRAPHIC STABILIZERS CIBA-GEIGY AG (CH) 1985-10-22 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 (1 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-20090259074-A1 PROCESS FOR PRODUCTION OF ALCOHOL COMPOUND XDH, ADH5, ADH1A LTA4H 1738/4885ESR1 2055/4885MAPT 3916/4885

“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.