SCHEMBL1004944

SCHEMBL1004944

[O]CCCCCCCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.45
FFAR1 O14842 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.36
CAMK2A Q9UQM7 1/20 0.35
MIF P14174 1/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
GAA P10253 1/20 0.30

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
SCHEMBL1006930 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1006439 1.00
SCHEMBL329265 1.00
SCHEMBL3028793 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1007247 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1008160 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1007034 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1006956 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1007009 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1
SCHEMBL1006246 1.00 GPR84 (0.45) GPR84FFAR1FFAR4LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0666847-B1 TRYPTAMINE ANALOGS WITH 5-HT1D SELECTIVITY ALLELIX BIOPHARMA (CA) 1998-06-17 EP claimed
US-5496957-A 5-HYDOXYTRYPTAMINE VIRGINIA COMMONWEALTH UNIVERSITY (US) 1996-03-05 US claimed
EP-0666847-A1 TRYPTAMINE ANALOGS WITH 5-HT1D SELECTIVITY Allelix Biopharmaceuticals Inc. (CA) 1995-08-16 EP claimed
WO-1995006638-A1 TRYPTAMINE ANALOGS WITH 5-HT1D SELECTIVITY ALLELIX BIOPHARMACEUTICALS INC. (CA) 1995-03-09 WO claimed
CN-105611920-B Preparation of hydroxy-diphenylmethane derivatives 泰拉科斯萨普有限责任公司 2021-07-16 CN disclosed
EP-3055281-B1 PREPARATION OF HYDROXY-BENZYLBENZENE DERIVATIVES THERACOS SUB LLC (US) 2020-01-08 EP disclosed
US-10093616-B2 Preparation of hydroxy-benzylbenzene derivatives THERACOS SUB, LLC (US) 2018-10-09 US disclosed
US-9725478-B2 Process for the preparation of benzylbenzene SGLT2 inhibitors THERACOS SUB, LLC (US) 2017-08-08 US disclosed
US-20160355471-A1 PREPARATION OF HYDROXY-BENZYLBENZENE DERIVATIVES THERACOSBIO, LLC 2016-12-08 US disclosed
US-9464043-B2 Preparation of hydroxy-benzylbenzene derivatives THERACOS SUB, LLC (US) 2016-10-11 US disclosed
EP-3055281-A1 PREPARATION OF HYDROXY-BENZYLBENZENE DERIVATIVES Theracos Sub, LLC (US) 2016-08-17 EP disclosed
US-20160207952-A1 PROCESS FOR THE PREPARATION OF BENZYLBENZENE SGLT2 INHIBITORS THERACOSBIO, LLC 2016-07-21 US disclosed
EP-0519423-A2 Phthalocyanine compounds and usage thereof MITSUI TOATSU CHEMICALS, Inc. (JP) 1992-12-23 EP disclosed
US-5053548-A Containing hydroxy substituents; nervous system disorders OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) 1991-10-01 US disclosed
EP-0382213-A2 Biphenyl derivative, nerve cell degeneration repairing or protecting agent and process for preparing a phenyl derivative contained in the agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed
EP-0382185-A2 Carbostyril derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-08-16 EP disclosed
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 US disclosed
US-4450307-A Hydroxy-containing bicycloalkane ether compounds TEXACO INC. (US) 1984-05-22 US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 US disclosed
US-4160020-A CELLULOSE ESTERS, CELLULOSE ETHERS ALZA CORPORATION (US) 1979-07-03 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 (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-20160207952-A1 PROCESS FOR THE PREPARATION OF BENZYLBENZENE SGLT2 INHIBITORS SLC5A2, SLC5A1, SLC2A4 GPR84 929/4885FFAR1 824/4885FFAR4 522/4885
US-20160355471-A1 PREPARATION OF HYDROXY-BENZYLBENZENE DERIVATIVES SLC5A2, SLC5A1, SLC2A8 GPR84 1335/4885FFAR1 366/4885FFAR4 207/4885
US-10093616-B2 Preparation of hydroxy-benzylbenzene derivatives SLC5A2, SLC5A1, SLC2A8 GPR84 1335/4885FFAR1 366/4885FFAR4 207/4885

“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.