SCHEMBL3150243

SCHEMBL3150243

COCc1ccccc1CO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.43
CYP4A11 Q02928 2/20 0.43
APOBEC3G Q9HC16 1/20 0.43
PDCD1 Q15116 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PDK2 Q15119 1/20 0.40
IDO1 P14902 4/20 0.38
PRKCE Q02156 2/20 0.38
MYLK Q15746 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PRKCG P05129 1/20 0.38
MAPT P10636 1/20 0.38
PRKCA P17252 1/20 0.38

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
SCHEMBL29618445 1.00 CYP4F2 (0.43) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL648491 0.87 IDO1 (0.44) KDM4ENPC1ALOX12HTTRAB9A
Methoxymethane SCHEMBL27638371 0.85 APOBEC3G (0.50) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL15116917 0.83 CYP4F2 (0.39) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL13083206 0.82 TDP1 (0.39) CYP4F2CYP4A11KDM4ENPC1ALOX12
Phenol SCHEMBL4103629 0.81 TDP1 (0.52) KDM4ENPC1ALOX12HTTRAB9A
SCHEMBL5685752 0.80 APOBEC3G (0.46) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL41139 0.79 APOBEC3G (0.60) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL29366632 0.79 APOBEC3G (0.60) CYP4F2CYP4A11APOBEC3GPDCD1CD274
SCHEMBL8459673 0.78 GABRA1 (0.42) KDM4EHTTNPSR1PDK2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021113679-A1 DIMERIC COMPOUNDS AS STING AGONISTS MERSANA THERAPEUTICS, INC. (US) 2021-06-10 WO disclosed
EP-3124491-A1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS AND VACCINE COMPOSITIONS CONTAINING THEM Infectious Disease Research Institute (US) 2017-02-01 EP disclosed
EP-2437753-B1 SYNTHETIC GLUCOPYRANOSYL LIPID ADJUVANTS AND VACCINE COMPOSITIONS CONTAINING THEM INFECTIOUS DISEASE RES INST (US) 2016-08-31 EP disclosed
CN-105330952-A TPV (thermoplastic vulcanizate) for heat-shrinkable casing pipe material of automobile wire harness ANHUI XIONGYA PLASTIC TECHNOLOGY CO LTD 2016-02-17 CN disclosed
US-8084448-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-7795636-B2 Organic semiconductor device, field-effect transistor, and their manufacturing methods CANON KABUSHIKI KAISHA (JP) 2010-09-14 US disclosed
EP-1555257-B1 PROCESS FOR PRODUCING AROMATIC NITRILE COMPOUND IHARA CHEMICAL IND CO (JP) 2010-01-20 EP disclosed
US-20090186490-A1 ORGANIC SEMICONDUCTOR DEVICE, FIELD-EFFECT TRANSISTOR, AND THEIR MANUFACTURING METHODS CANON KABUSHIKI KAISHA (JP) 2009-07-23 US disclosed
US-20090181928-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 US disclosed
EP-1661877-B1 PROCESS FOR PRODUCING AROMATIC ALDEHYDE IHARA CHEMICAL IND CO (JP) 2009-05-13 EP disclosed
US-7262316-B2 Process for producing aromatic nitrile compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-08-28 US disclosed
US-7220736-B2 Pyrimidine compounds TANABE SEIYAKU CO., LTD. (JP) 2007-05-22 US disclosed
US-7220736-B2 Pyrimidine compounds TANABE SEIYAKU CO., LTD. (JP) 2007-05-22 US disclosed
US-20070004934-A1 Process for producing aromatic aldehyde IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-01-04 US disclosed
EP-1661877-A1 PROCESS FOR PRODUCING AROMATIC ALDEHYDE Ihara Chemical Industry Co., Ltd. (JP) 2006-05-31 EP disclosed
US-20060069282-A1 Process for producing aromatic nitrile compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2006-03-30 US disclosed
CN-1659155-A 1-phenylalkyl-piperazines RECORDATI IRELAND LTD (IE) 2005-08-24 CN disclosed
EP-1555257-A1 PROCESS FOR PRODUCING AROMATIC NITRILE COMPOUND IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2005-07-20 EP disclosed
US-20040072839-A1 1-Phenylalkylpiperazines RECORDATI S.A. (CH) 2004-04-15 US disclosed
EP-1277741-A1 CYCLIC COMPOUNDS TANABE SEIYAKU CO., LTD. (JP) 2003-01-22 EP 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-20040072839-A1 1-Phenylalkylpiperazines HTR5A, HTR1A, HTR1D CYP4F2 1307/4885CYP4A11 943/4885APOBEC3G 3521/4885
US-20090181928-A1 ORGANIC COMPOUNDS PTPRS, PTPRO, PTPRC CYP4F2 1909/4885CYP4A11 2400/4885APOBEC3G 4800/4885
US-20060069282-A1 Process for producing aromatic nitrile compound ODC1, ALKBH3, GNMT CYP4F2 303/4885CYP4A11 209/4885APOBEC3G 1490/4885
US-20070004934-A1 Process for producing aromatic aldehyde ALKBH3, AOX1, ALDH3A1 CYP4F2 277/4885CYP4A11 368/4885APOBEC3G 1271/4885

“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.