SCHEMBL2536091

SCHEMBL2536091

O=Cc1cccc(OCC(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 9/20 0.57
▸ MAOB P27338 9/20 0.57
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ SRC P12931 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ CYP3A4 P08684 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ HDAC4 P56524 1/20 0.44
▸ MEF2D Q14814 1/20 0.44
▸ GPR3 P46089 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL29467074 1.00 MAOA (0.57) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL2534095 0.87 MAOA (0.54) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL2203216 0.86 MAOA (0.60) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL21910885 0.85 MAOA (0.53) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL2029147 0.84 MAOA (0.51) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL2531605 0.83 MAOB (0.54) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL17103203 0.83 MAOA (0.57) MAOAMAOBNPC1RAB9ATDP1
SCHEMBL16953003 0.83 CYP2C19 (0.46) MAOAMAOBALDH1A1CYP3A4HPGD
SCHEMBL16952743 0.83 CYP2C19 (0.43) MAOAMAOBTDP1ALDH1A1CYP3A4
SCHEMBL6493712 0.82 ALDH1A1 (0.57) MAOAMAOBNPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12508239-B2 Alcohol derivatives as Kv7 potassium channel openers for use in epilepsy or seizures H. LUNDBECK A/S (DK) 2025-12-30 — — US disclosed
EP-4007571-B1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS FOR USE IN EPILEPSY OR SEIZURES H LUNDBECK AS (DK) 2025-06-18 — — EP disclosed
EP-4241843-B1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H LUNDBECK AS (DK) 2025-05-21 — — EP disclosed
US-12258305-B2 Alcohol derivatives as Kv7 potassium channel openers H. LUNDBECK A/S (DK) 2025-03-25 — — US disclosed
US-20230303486-A1 CYCLOBUTYL-UREA DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2023-09-28 — — US disclosed
EP-4241843-A2 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. Lundbeck A/S (DK) 2023-09-13 — — EP disclosed
EP-4241843-A2 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H. Lundbeck A/S (DK) 2023-09-13 — — EP disclosed
CN-116589375-A Alcohol derivatives as Kv7 potassium channel openers H.隆德贝克有限公司 2023-08-15 — — CN disclosed
EP-3755684-B1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H LUNDBECK AS (DK) 2023-07-12 — — EP disclosed
EP-3755684-B1 ALCOHOL DERIVATIVES AS KV7 POTASSIUM CHANNEL OPENERS H LUNDBECK AS (DK) 2023-07-12 — — EP 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-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-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
EP-0197868-B1 PROCESS FOR THE PREPARATION OF DICHLOROTRIFLUOROETHOXY AND ETHYLTHIOAROMATIC DERIVATIVES RHONE-POULENC CHIMIE (FR) 1988-05-18 — — EP disclosed
US-4256749-A HYPOTENSIVE AGENTS, CIRCULATION BAYER AKTIENGESELLSCHAFT (DE) 1981-03-17 — — 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 (4 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-20230303486-A1 CYCLOBUTYL-UREA DERIVATIVES KCNA4, KCNMB4, KCNA7 MAOA 1873/4885MAOB 872/4885NPC1 4063/4885
US-20020120011-A1 Substituted N, N-disubstituted diamino compounds useful for inhibiting cholesteryl ester transfer protein activity CETP, PCTP, DBI MAOA 2106/4885MAOB 1480/4885NPC1 7/4885
US-12508239-B2 Alcohol derivatives as Kv7 potassium channel openers for use in epilepsy or seizures KCNN3, KCNN1, KCNN2 MAOA 698/4885MAOB 1372/4885NPC1 385/4885
US-12258305-B2 Alcohol derivatives as Kv7 potassium channel openers KCNA7, KCNK17, KCNQ1 MAOA 1799/4885MAOB 1994/4885NPC1 1244/4885

“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.

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