SCHEMBL4397448

SCHEMBL4397448

CCCCOc1cccc(OCCCC)c1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.63
LTA4H P09960 2/20 0.63
GPBAR1 Q8TDU6 2/20 0.57
PLA2G4B P0C869 1/20 0.57
CYSLTR2 Q9NS75 1/20 0.57
CYSLTR1 Q9Y271 1/20 0.57
KMT2A Q03164 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C19 P33261 2/20 0.56
TLR4 O00206 1/20 0.56
TLR2 O60603 1/20 0.56
CYP19A1 P11511 1/20 0.56
CYP2C9 P11712 1/20 0.56
THRB P10828 1/20 0.54
CYP2D6 P10635 1/20 0.53
MAPK1 P28482 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SMPD1 P17405 2/20 0.51

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
1-Butyloxy-3-Propoxybenzene SCHEMBL3390925 0.96 TSHR (0.59) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
1-Butyloxy-3-Ethoxybenzene SCHEMBL3459049 0.94 MAPK1 (0.62) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL9487103 0.94 LTA4H (0.68) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL11663051 0.93 TSHR (0.72) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
1-Butyloxy-3-Methoxybenzene SCHEMBL1071738 0.92 MAPK1 (0.61) TSHRLTA4HKMT2ACYP1A2CYP2C19
SCHEMBL3905859 0.91 TSHR (0.76) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL6677146 0.91 TSHR (0.76) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL17138169 0.91 TSHR (0.76) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL4208924 0.91 TSHR (0.76) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2
SCHEMBL16699620 0.91 TSHR (0.76) TSHRLTA4HGPBAR1PLA2G4BCYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151159-A1 COMPOUND FOR FORMING HARDMASK, HARDMASK COMPOSITION INCLUDING THE COMPOUND, AND METHOD OF MANUFACTURING INTEGRATED CIRCUIT DEVICE USING THE HARDMASK COMPOSITION SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-05-18 US disclosed
CN-113260679-A Process for preparing triazine intermediates and process for preparing UV absorbers thereof 巴斯夫欧洲公司 2021-08-13 CN disclosed
CN-113260611-A Method for producing UV absorbers 巴斯夫欧洲公司 2021-08-13 CN disclosed
US-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed
US-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF RNS CO.,LTD. (KR) 2015-10-08 US disclosed
CN-104487459-A Modified cis-1, 4-polybutadiene and method for producing same UBE INDUSTRIES 2015-04-01 CN disclosed
US-7582390-B2 Two-photon absorbing polymerization method, two-photon absorbing optical recording material and two-photon absorbing optical recording method FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed
US-7528124-B2 1,3-dihydro-2H-indol-2-one derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2009-05-05 US disclosed
US-20060276449-A1 1,3-Dihydro-2h-indol-2-one derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1659121-A1 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-05-24 EP disclosed
US-20040245432-A1 Two-photon absorbing polymerization method, two-photon absorbing optical recording material and two-photon absorbing optical recording method FUJI PHOTO FILM CO., LTD. 2004-12-09 US disclosed
US-5965776-A PHOTOINITIATORS FOR THE PHOTOPOLYMERIZATION OF ETHYLENICALLY UNSATURATED COMPOUNDS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-10-12 US disclosed
US-5767169-A STORAGE STABLE, NONHYDROLYZING CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-06-16 US disclosed
CN-1130632-A Alkoxyphenyl substituted bisacylphosphine oxides CIBA GEIGY AG (CH) 1996-09-11 CN disclosed
EP-0210140-B1 INHIBITORS OF BENZYLAMINOXIDASES, SELECTIVE WITH RESPECT TO OTHER AMINOXIDASES CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1990-06-13 EP disclosed
US-4888283-A Selective inhibitors of benzylaminoxidases with respect to other aminoxidases CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1989-12-19 US disclosed
EP-0210140-A2 Inhibitors of benzylaminoxidases, selective with respect to other aminoxidases CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1987-01-28 EP disclosed
US-4309500-A CONTAINING ABSORBER OF ULTRAVIOLET LIGHT FUJI PHOTO FILM CO., LTD. (JP) 1982-01-05 US disclosed
US-4191576-A SULFONYL-SUBSTITUTED PYRROLIDINE, OXAZOLIDINE OR THIAZOLIDINE FUJI PHOTO FILM CO., LTD. (JP) 1980-03-04 US disclosed
US-4125512-A RESORCINOL DONOR, FORMALDEHYDE DONOR, CALCIUM SILICATE, GROUP 2A OR 3A METAL OXIDE BAYER AKTIENGESELLSCHAFT (DE) 1978-11-14 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 (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-20060276449-A1 1,3-Dihydro-2h-indol-2-one derivative AVPR1B, AVPR2, AVPR1A TSHR 85/4885LTA4H 4491/4885GPBAR1 413/4885
US-20150283051-A1 DERIVATIVE OF NOVEL POLYHYDROXY AROMATIC COMPOUND AND USE THEREOF HRH3, CBR3, H1-0 TSHR 4026/4885LTA4H 1191/4885GPBAR1 3596/4885

“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.