SCHEMBL3239903

SCHEMBL3239903

COc1ccc(CO)cc1OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.60
MAPK1 P28482 1/20 0.59
HSD17B10 Q99714 1/20 0.59
SMPD1 P17405 2/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
ABCB1 P08183 1/20 0.57
ABCG2 Q9UNQ0 1/20 0.57
KDM4E B2RXH2 3/20 0.56
LMNA P02545 2/20 0.56
HTT P42858 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KMT2A Q03164 2/20 0.56
NPY1R P25929 1/20 0.56
NPY2R P49146 1/20 0.56
NPC1 O15118 1/20 0.56
POLB P06746 1/20 0.56
RAB9A P51151 1/20 0.56
CYP1A2 P05177 1/20 0.56

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
SCHEMBL31361425 1.00 BCHE (0.60) BCHEMAPK1HSD17B10SMPD1HDAC1
SCHEMBL31725848 0.94 NPC1 (0.63) BCHEHSD17B10ABCB1ABCG2KDM4E
SCHEMBL698056 0.94 NPC1 (0.63) BCHEHSD17B10ABCB1ABCG2KDM4E
SCHEMBL584781 0.90 SLC2A1 (0.56) BCHEHSD17B10HTTSMN1; SMN2KMT2A
SCHEMBL30280404 0.90 SLC2A1 (0.56) BCHEHSD17B10HTTSMN1; SMN2KMT2A
SCHEMBL12296058 0.88 BCHE (0.61) BCHEMAPK1HSD17B10SMPD1HDAC1
SCHEMBL6489381 0.87 NPC1 (0.56) BCHESMPD1KDM4ELMNAHTT
SCHEMBL6035606 0.86 MEN1 (0.60) MAPK1HSD17B10KDM4ELMNAHTT
SCHEMBL8554822 0.85 MAPK1 (0.64) BCHEMAPK1HSD17B10SMPD1HDAC1
SCHEMBL5753220 0.85 SRD5A1 (0.53) BCHESMPD1HDAC1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113999232-B MAT2A inhibitors 南京正大天晴制药有限公司 2025-01-07 CN disclosed
CN-113999232-A MAT2A inhibitors 南京正大天晴制药有限公司 2022-02-01 CN disclosed
EP-3689817-A1 PROCESS FOR PRODUCING HYDROGEN OR HEAVY HYDROGENS, AND HYDROGENATION (PROTIATION, DEUTERATION OR TRITIATION) OF ORGANIC COMPOUNDS USING SAME Shiono Chemical Co., Ltd. (JP) 2020-08-05 EP disclosed
EP-2607300-B1 PROCESS FOR HYDROGENATION OF ORGANIC COMPOUNDS USING HYDROGEN OR HEAVY HYDROGEN SHIONO CHEMICAL CO LTD (JP) 2020-05-13 EP disclosed
EP-2607300-B1 PROCESS FOR HYDROGENATION OF ORGANIC COMPOUNDS USING HYDROGEN OR HEAVY HYDROGEN SHIONO CHEMICAL CO LTD (JP) 2020-05-13 EP disclosed
US-9708310-B2 Phenanthroindolizidine and phenanthroquinolizidine alkaloid having a hydroxyl group on the phenanthrene ring thereof, preparation method and use thereof CHINA MEDICAL UNIVERSITY (TW) 2017-07-18 US disclosed
US-9708310-B2 Phenanthroindolizidine and phenanthroquinolizidine alkaloid having a hydroxyl group on the phenanthrene ring thereof, preparation method and use thereof CHINA MEDICAL UNIVERSITY (TW) 2017-07-18 US disclosed
US-9676622-B2 Process for producing hydrogen or heavy hydrogens, and hydrogenation (protiation, deuteration or tritiation) of organic compounds using same SHIONO CHEMICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-9676622-B2 Process for producing hydrogen or heavy hydrogens, and hydrogenation (protiation, deuteration or tritiation) of organic compounds using same SHIONO CHEMICAL CO., LTD. (JP) 2017-06-13 US disclosed
US-20170152257-A1 PHENANTHROINDOLIZIDINE AND PHENANTHROQUINOLIZIDINE ALKALOID HAVING A HYDROXYL GROUP ON THE PHENANTHRENE RING THEREOF, PREPARATION METHOD AND USE THEREOF CHINA MEDICAL UNIVERSITY (TW) 2017-06-01 US disclosed
US-6228859-B1 ANTIASTHMATIC, ANTIINFLAMMATORY, ANTIALLERGEN AND ANTIDEPRESSANT AGENTS EURO-CELTIQUE S.A. (LU) 2001-05-08 US disclosed
WO-2001011967-A1 NOVEL HYPOXANTHINE AND THIOHYPOXANTHINE COMPOUNDS EURO-CELTIQUE S.A. (LU) 2001-02-22 WO disclosed
EP-1045849-A1 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY Euro-Celtique S.A. (LU) 2000-10-25 EP disclosed
US-6071945-A ANTICARCINOGENIC OR ANTITUMOR AGENTS ADIR ET COMPAGNIE (FR) 2000-06-06 US disclosed
EP-0982308-A1 Derivatives of the 8H-(2,3-b)-pyrrolizine-8-one, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-03-01 EP disclosed
CN-1244529-A Novel 8H-thiophene [2,3-b] pyrrolinezine-8-on compound, its preparing method and their medicinal compounds containing them ADIR (FR) 2000-02-16 CN disclosed
WO-1999031102-A1 PURINE DERIVATIVES HAVING PHOSPHODIESTERASE IV INHIBITION ACTIVITY EURO-CELTIQUE, S.A. (LU) 1999-06-24 WO disclosed
EP-0183216-B1 N-(ARALKOXYBENZYL)-4(BENZHYDRYL) PIPERIDINES G.D. Searle & Co. (US) 1989-07-19 EP disclosed
US-4650874-A CARDIOVASCULAR AGENTS G. D. SEARLE & CO. (US) 1987-03-17 US disclosed
EP-0183216-A1 N-(Aralkoxybenzyl)-4(benzhydryl) piperidines G.D. Searle & Co. (US) 1986-06-04 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 (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-20170152257-A1 PHENANTHROINDOLIZIDINE AND PHENANTHROQUINOLIZIDINE ALKALOID HAVING A HYDROXYL GROUP ON THE PHENANTHRENE RING THEREOF, PREPARATION METHOD AND USE THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, PAH, HIPK4 BCHE 176/4885MAPK1 3795/4885HSD17B10 332/4885

“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.