SCHEMBL585546

SCHEMBL585546

O=C(O)COc1cccc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.68
MRGPRX4 Q96LA9 1/20 0.59
MAOB P27338 2/20 0.58
AOC3 Q16853 1/20 0.58
LMNA P02545 2/20 0.58
ALOX15 P16050 1/20 0.56
NR4A2 P43354 1/20 0.56
PTGDR2 Q9Y5Y4 2/20 0.55
PPARG P37231 1/20 0.54
PPARA Q07869 1/20 0.54
ALDH1A1 P00352 3/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 1/20 0.53
HTT P42858 1/20 0.53
ENPP2 Q13822 1/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA4 P22748 1/20 0.53
CA9 Q16790 1/20 0.53

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
SCHEMBL31645913 1.00 KDM4E (0.68) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL11112064 0.87 KDM4E (0.57) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL9811742 0.85 KDM4E (0.67) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL10932863 0.85 KDM4E (0.71) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL30517922 0.85 KDM4E (0.67) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL13642053 0.85 KDM4E (0.67) KDM4EMRGPRX4MAOBAOC3LMNA
SCHEMBL1451309 0.84 KDM4E (0.57) KDM4EMRGPRX4LMNANR4A2PPARG
SCHEMBL30953672 0.84 KDM4E (0.57) KDM4EMRGPRX4LMNANR4A2PPARG
SCHEMBL30831879 0.83 SMN1; SMN2 (0.65) LMNAALOX15NR4A2PPARGPPARA
SCHEMBL1986392 0.83 SMN1; SMN2 (0.65) LMNAALOX15NR4A2PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080108115-A1 ENHANCED PRODUCTION OF TAXOL AND TAXANES BY CELL CULTURES OF TAXUS SPECIES DFB BIOTECH, INCORPORATED (US) 2008-05-08 US claimed
US-7264951-B1 Enhanced production of taxol and taxanes by cell cultures of Taxus species PHYTON, INC. (US) 2007-09-04 US claimed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
US-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2023-10-26 US disclosed
CN-110143932-B Piperazinone derivatives, process for producing the same, inhibitor, and method for controlling root-parasitic weeds 南开大学 2022-09-16 CN disclosed
US-20220026805-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-01-27 US disclosed
WO-2021236395-A1 CB-0406 CHOLINE SALT CYMABAY THERAPEUTICS, INC. (US) 2021-11-25 WO disclosed
WO-2021236394-A1 CB-0406 TROMETHAMINE SALT CYMABAY THERAPEUTICS, INC. (US) 2021-11-25 WO disclosed
WO-2021221169-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS RAQUALIA PHARMA INC. (JP) 2021-11-04 WO disclosed
EP-3560928-B1 FUSED IMIDAZOLE COMPOUND HAVING INDOLEAMINE 2,3-DIOXYGENASE INHIBITORY ACTIVITY SHENZHEN CHIPSCREEN BIOSCIENCES CO LTD (CN) 2021-10-20 EP disclosed
CN-108203438-B Fused imidazole compounds having indoleamine 2,3-dioxygenase inhibitory activity 深圳微芯生物科技股份有限公司 2021-09-28 CN disclosed
US-4416687-A 3,5-Bis (trifluoromethyl)phenoxy carboxylic acids and derivatives thereof MONSANTO COMPANY (US) 1983-11-22 US disclosed
EP-0088066-A1 3,5-Bis (trifluoromethyl) phenoxy carboxylic acids and derivatives thereof MONSANTO COMPANY (US) 1983-09-07 EP disclosed
US-4138577-A 11-Deoxy-cis-4,5-didehydro-ω-aryl-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138575-A 11-Deoxy-16-phenoxy-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138576-A 11-Deoxy-2,2-difluoro-ω-aryl-PGF compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4138573-A 11-Deoxy-2,2-difluoro-ω-aryl-PGE compounds THE UPJOHN COMPANY (US) 1979-02-06 US disclosed
US-4126754-A 11-Deoxy-cis-4,5-didehydro-ω-aryl-PGE compounds THE UPJOHN COMPANY (US) 1978-11-21 US disclosed
US-4090862-A Novel phenoxycarboxylic acid aryloxy(thio)carbonylaminomethyl esters and their use for regulating plant growth BAYER AKTIENGESELLSCHAFT (DT) 1978-05-23 US disclosed
US-4020167-A COMBATTING NARCOSIS THE DOW CHEMICAL COMPANY (US) 1977-04-26 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 (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-20230339934-A1 PYRIMIDIN-4(3H)-ONE DERIVATIVES AS TRPV4 ANTAGONISTS TRPV4, TRPV1, TRPV2 KDM4E 2319/4885MRGPRX4 49/4885MAOB 3687/4885

“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.