SCHEMBL496206

SCHEMBL496206

O=C(O)c1cccc(C(F)(F)F)n1

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.64
KDM4E B2RXH2 3/20 0.61
ALOX15 P16050 1/20 0.61
TSHR P16473 1/20 0.61
ACMSD Q8TDX5 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
AHR P35869 1/20 0.51
TAS2R14 Q9NYV8 2/20 0.50
LMNA P02545 1/20 0.44
GNE Q9Y223 1/20 0.43
MRGPRX4 Q96LA9 2/20 0.42
KMT2A Q03164 1/20 0.42
MGAM O43451 1/20 0.41
PGK1 P00558 1/20 0.41
PGK2 P07205 1/20 0.41
PTGER1 P34995 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
IRAK4 Q9NWZ3 1/20 0.41

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
SCHEMBL29375278 1.00 P2RX7 (0.64) P2RX7KDM4EALOX15TSHRACMSD
Methylene Chloride SCHEMBL28293379 0.93 P2RX7 (0.61) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL27737055 0.88 P2RX7 (0.68) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL22835203 0.85 KDM4E (0.57) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL19029854 0.85 KDM4E (0.57) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL14354517 0.85 KDM4E (0.57) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL29381032 0.85 KDM4E (0.57) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL28015459 0.84 P2RX7 (0.64) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL13043982 0.82 P2RX7 (0.62) P2RX7KDM4EALOX15TSHRACMSD
SCHEMBL29709918 0.82 P2RX7 (0.62) P2RX7KDM4EALOX15TSHRACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119841727-A Method for directly preparing carboxylic ester compound from aromatic aldehyde, ketone and carboxylic acid 湖南第一师范学院 2025-04-18 CN claimed
CN-107333975-B A kind of novel processing step of chromium picolinate based food additive 淄博职业学院 2019-10-08 CN claimed
CN-107400256-B A kind of preparation method of uvioresistant plastic additive 深圳市精研科洁科技股份有限公司 2019-04-19 CN claimed
CN-107445941-A The preparation method and application of triazole compound with immunosuppressive activity 河南科技大学第附属医院 2017-12-08 CN claimed
CN-107400256-A A kind of preparation method of uvioresistant plastic additive 毛阿龙 2017-11-28 CN claimed
CN-107382989-A A kind of synthetic method with oxazole ring structure immunosuppressive drug 河南科技大学第附属医院 2017-11-24 CN claimed
CN-107337638-A A kind of high-efficiency synthesis method of pyridine carboxylic acid based food additive 侯茜茜 2017-11-10 CN claimed
CN-107333975-A A kind of novel processing step of chromium picolinate based food additive 淄博职业学院 2017-11-10 CN claimed
CN-107298677-A The preparation method and application of evil azole compounds with immunosuppressive activity 侯茜茜 2017-10-27 CN claimed
US-9428456-B2 1-[m-carboxamido(hetero)aryl-methyl]-heterocyclyl-carboxamide derivatives ACTELION PHARMACEUTICALS LTD (CH) 2016-08-30 US claimed
US-20130345199-A1 1-[M-CARBOXAMIDO(HETERO)ARYL-METHYL]-PIPERIDINE-4-CARBOXAMIDE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2013-12-26 US claimed
EP-2310356-B1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME LUNDBECK & CO AS H (DK) 2013-08-14 EP claimed
CN-102595893-A Spirolactam derivatives and uses of same LUNDBECK & CO AS H 2012-07-18 CN claimed
JP-2011529057-A 2011-12-01 JP claimed
CN-102105437-A Adamantyl diamide derivatives and uses of same LUNDBECK & CO AS H 2011-06-22 CN claimed
CN-102083827-A Thiazolidine compounds as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD 2011-06-01 CN claimed
US-20110105491-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-05-05 US claimed
WO-2010011570-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 WO claimed
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME H. LUNDBECK A/S (DK) 2010-01-28 US claimed
WO-2010004507-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-01-14 WO claimed

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-20110105491-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, OXTR P2RX7 363/4885KDM4E 3641/4885ALOX15 1712/4885
US-20100022546-A1 ADAMANTYL DIAMIDE DERIVATIVES AND USES OF SAME QDPR, ADM2, PDE3B P2RX7 1517/4885KDM4E 2749/4885ALOX15 3886/4885
US-20130345199-A1 1-[M-CARBOXAMIDO(HETERO)ARYL-METHYL]-PIPERIDINE-4-CARBOXAMIDE DERIVATIVES CXCR1, CXCR5, CXCR4 P2RX7 8/4885KDM4E 1526/4885ALOX15 3884/4885

“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.