SCHEMBL1758781

SCHEMBL1758781

Cc1cc(C(=O)c2ccc(O)cc2)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.75
SMN1; SMN2 Q16637 1/20 0.75
HSD17B1 P14061 5/20 0.61
HSD17B2 P37059 5/20 0.61
LMNA P02545 3/20 0.60
MAPT P10636 3/20 0.60
ESR1 P03372 1/20 0.60
ESR2 Q92731 1/20 0.60
PKM P14618 1/20 0.60
HPGD P15428 1/20 0.60
DYRK1A Q13627 1/20 0.56
DYRK1B Q9Y463 1/20 0.56
SRD5A2 P31213 1/20 0.52
TDP1 Q9NUW8 2/20 0.52
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPK1 P28482 1/20 0.50
SIRT1 Q96EB6 1/20 0.49
SLC22A6 Q4U2R8 1/20 0.48
SLC22A8 Q8TCC7 1/20 0.48

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
SCHEMBL31574452 0.96 HTT (0.70) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL31574447 0.96 HTT (0.70) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL11053174 0.94 HTT (0.64) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL1758239 0.92 HTT (0.61) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL31621156 0.92 HTT (0.61) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL31574429 0.88 HTT (0.57) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL9752047 0.86 SRD5A2 (0.59) HTTSMN1; SMN2HSD17B1HSD17B2MAPT
SCHEMBL5962849 0.86 HSD17B1 (0.64) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL3468499 0.85 HTT (0.55) HTTSMN1; SMN2HSD17B1HSD17B2LMNA
SCHEMBL15851085 0.85 HSD17B1 (0.58) HTTSMN1; SMN2HSD17B1HSD17B2HPGD

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111354964-A Amphoteric ion-containing polymer and flow battery electrolyte membrane 东丽先端材料研究开发(中国)有限公司 2020-06-30 CN disclosed
US-20160124327-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, IMAGE FORMING APPARATUS, AND POLYARYLATE RESIN MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-05 US disclosed
US-20160124327-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, IMAGE FORMING APPARATUS, AND POLYARYLATE RESIN MITSUBISHI CHEMICAL CORPORATION (JP) 2016-05-05 US disclosed
EP-1767090-B1 CLATHRATE COMPOUND, METHOD OF CONTROLLING CONCENTRATION OF AQUEOUS SOLUTION OF AGRICULTURAL-CHEMICAL ACTIVE INGREDIENT, AND AGRICULTURAL-CHEMICAL PREPARATION NIPPON SODA CO (JP) 2015-08-12 EP disclosed
US-7943803-B2 Clathrate compound, method for controlling concentration of aqueous agricultural chemical active ingredient solution, and agricultural chemical formulation NIPPON SODA CO., LTD. (JP) 2011-05-17 US disclosed
US-20100274006-A1 Clathrate compound, method for controlling concentration of aqueous agricultural chemical active ingredient solution, and agricultural chemical formulation NIPPON SODA CO., LTD (JP) 2010-10-28 US disclosed
US-7737309-B2 Clathrate compound, method for controlling concentration of aqueous agricultural chemical active ingredient solution, and agricultural chemical formulation NIPPON SODA CO., LTD. (JP) 2010-06-15 US disclosed
US-20070281929-A1 Clathrate Compound, Method for Controlling Concentration of Aqueous Agricultural Chemical Active Ingredient Solution, and Agricultural Chemical Formulation NIPPON SODA CO., LTD. (JP) 2007-12-06 US disclosed
EP-1767090-A1 CLATHRATE COMPOUND, METHOD OF CONTROLLING CONCENTRATION OF AQUEOUS SOLUTION OF AGRICULTURAL-CHEMICAL ACTIVE INGREDIENT, AND AGRICULTURAL-CHEMICAL PREPARATION NIPPON SODA CO., LTD. (JP) 2007-03-28 EP disclosed
US-20030191023-A1 Thermosensitive recording material FUJI PHOTO FILM CO., LTD. 2003-10-09 US disclosed
US-5128429-A Low temperature block polymerization without randomization RAYCHEM LIMITED (GB) 1992-07-07 US disclosed
EP-0154506-B1 PREPARATION OF ORGANIC POLYMERS RAYCHEM LIMITED (GB) 1992-02-05 EP disclosed
US-4999411-A Polythioethers, polythiocarbonates, polythioamides, polythioimides RAYCHEM LIMITED (GB) 1991-03-12 US disclosed
US-4960835-A ENGINEERING THERMOPLASTICS RAYCHEM LIMITED (GB) 1990-10-02 US disclosed
US-4845179-A CONDENSATION POLYMERIZATION RAYCHEM LIMITED (GB) 1989-07-04 US disclosed
EP-0154506-A2 Preparation of organic polymers RAYCHEM LIMITED (GB) 1985-09-11 EP disclosed
US-4371690-A POLYESTERS, POLYAMIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-02-01 US disclosed
US-4281106-A Heat-resistant, rigid polymers from difunctional 9,10-dihydro-9,10-ethanoanthracenes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1981-07-28 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-20100274006-A1 Clathrate compound, method for controlling concentration of aqueous agricultural chemical active ingredient solution, and agricultural chemical formulation STOM, ALB, GANC HTT 70/4885SMN1; SMN2 4433/4885HSD17B1 3498/4885
US-20070281929-A1 Clathrate Compound, Method for Controlling Concentration of Aqueous Agricultural Chemical Active Ingredient Solution, and Agricultural Chemical Formulation CA3, CA2, STOM HTT 389/4885SMN1; SMN2 4591/4885HSD17B1 2569/4885

“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.