SCHEMBL3277997

SCHEMBL3277997

Cc1cccc(C(F)(F)C(F)(F)F)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 4/20 0.48
KIF11 P52732 2/20 0.43
PTPN5 P54829 1/20 0.43
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
KCNH2 Q12809 1/20 0.41
MAPK1 P28482 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
NFE2L2 Q16236 1/20 0.39
CYP1A2 P05177 1/20 0.39
MAPT P10636 1/20 0.39
KCNK3 O14649 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL29749591 1.00 ACHE (0.48) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL30144876 0.84 ACHE (0.46) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL25875486 0.84 ACHE (0.46) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL19360441 0.84 ACHE (0.46) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL822037 0.82 ACHE (0.48) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL5360594 0.82 ACHE (0.48) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL148048 0.81 NFE2L2 (0.55) ACHEKIF11PTPN5MAPK1ALDH1A1
SCHEMBL822098 0.81 ACHE (0.52) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL25093467 0.81 PTPN5 (0.44) ACHEKIF11PTPN5CYP3A4CYP2D6
SCHEMBL19642633 0.81 PTPN5 (0.44) ACHEKIF11PTPN5CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4696748-A1 PERFLUOROPOLYETHER GEL CURABLE COMPOSITION, PERFLUOROPOLYETHER GEL CURED PRODUCT, AND ELECTRONIC COMPONENT SEALED WITH SAID CURED PRODUCT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2026-02-18 EP disclosed
US-12545761-B2 Photocurable fluoropolyether-based elastomer composition and bonding method thereof SHIN-ETSU CHEMICAL CO., LTD. (JP) 2026-02-10 US disclosed
WO-2024214452-A1 PERFLUOROPOLYETHER GEL CURABLE COMPOSITION, PERFLUOROPOLYETHER GEL CURED PRODUCT, AND ELECTRONIC COMPONENT SEALED WITH SAID CURED PRODUCT 信越化学工業株式会社 2024-10-17 WO disclosed
US-20220396662-A1 PHOTOCURABLE FLUOROPOLYETHER-BASED ELASTOMER COMPOSITION AND BONDING METHOD THEREOF SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-12-15 US disclosed
EP-4059994-A1 PHOTOCURABLE FLUOROPOLYETHER ELASTOMER COMPOSITION AND BONDING METHOD FOR SAME Shin-Etsu Chemical Co., Ltd. (JP) 2022-09-21 EP disclosed
US-20220002580-A1 METHOD FOR FORMING COATING FILM OF PHOTOCURABLE FLUOROPOLYETHER-BASED ELASTOMER COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-01-06 US disclosed
EP-3892391-A1 METHOD FOR FORMING COATING FILM OF PHOTOSETTING FLUOROPOLYETHER-BASED ELASTOMER COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-10-13 EP disclosed
WO-2020116125-A1 METHOD FOR FORMING COATING FILM OF PHOTOSETTING FLUOROPOLYETHER-BASED ELASTOMER COMPOSITION 信越化学工業株式会社 2020-06-11 WO disclosed
EP-3053945-B1 PHOTO-CURABLE FLUOROPOLYETHER-BASED RUBBER COMPOSITION, CURING METHOD THEREOF AND CURED PRODUCT OBTAINED BY THE CURING METHOD SHINETSU CHEMICAL CO (JP) 2017-12-27 EP disclosed
US-9840601-B2 Method for producing a cured product SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-12-12 US disclosed
US-6458803-B1 COMPOSITIONS AND METHODS FOR TREATING ATHEROSCLEROSIS AND OTHER CORONARY ARTERY DISEASES. PREFERRED TERTIARY-HETEROALKYLAMINE COMPOUNDS ARE SUBSTITUTED N-PHENYL-N-HETEROARALKYL AMINOALCOHOLS. A PREFERRED SPECIFIC G.D. SEARLE & CO. 2002-10-01 US disclosed
US-6455519-B1 TREATING ATHEROSCLEROSIS AND CARDIOVASCULAR DISORDERS G.D. SEARLE & CO. 2002-09-24 US disclosed
US-6451830-B1 Use of substituted N,N-disubstituted non-fused heterocyclo amino compounds for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2002-09-17 US disclosed
US-6451823-B1 Use of substituted N-phenoxy-N-phenyl aminoalcohol compounds for inhibiting cholesteryl ester transfer protein activity G.D. SEARLE & CO. 2002-09-17 US disclosed
US-6448295-B1 TREATING CARDIOVASCULAR DISEASE; ATHEROSCLEROSIS, DYSLIPIDEMA HYPERCHOLESTEROLAEMIA; DECREASING CONCENTRATIONS OF LOW DENSITY LIPOPROTEIN AND RAISING LEVEL OF HIGH DENSITY LIPOPROTEIN G.D. SEARLE & CO. 2002-09-10 US disclosed
US-20020120011-A1 Substituted N, N-disubstituted diamino compounds useful for inhibiting cholesteryl ester transfer protein activity SIKORSKI JAMES A (US) 2002-08-29 US disclosed
EP-1115695-A1 (R)-CHIRAL HALOGENATED 1-SUBSTITUTEDAMINO-(N+1)-ALKANOLS USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY Monsanto Company (US) 2001-07-18 EP disclosed
EP-1115693-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL $i(TERTIARY)-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY Monsanto Company (US) 2001-07-18 EP disclosed
WO-2000018724-A1 (R)-CHIRAL HALOGENATED 1-SUBSTITUTEDAMINO-(n+1)-ALKANOLS USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO disclosed
WO-2000018721-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL TERTIARY-HETEROALKYLAMINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY MONSANTO COMPANY (US) 2000-04-06 WO 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-12545761-B2 Photocurable fluoropolyether-based elastomer composition and bonding method thereof RAD51, FRG1, COL2A1 ACHE 4765/4885KIF11 1845/4885PTPN5 4575/4885
US-20020120011-A1 Substituted N, N-disubstituted diamino compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, PCTP, DBI ACHE 4445/4885KIF11 4638/4885PTPN5 3739/4885

“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.