SCHEMBL1624419

SCHEMBL1624419

OCCCCc1ccc(Br)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 4/20 0.52
▸ TAAR1 Q96RJ0 3/20 0.50
▸ HTR2A P28223 1/20 0.50
▸ CYP4A11 Q02928 2/20 0.48
▸ CYP4F2 P78329 1/20 0.48
▸ CYP11B1 P15538 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ HMOX1 P09601 1/20 0.44
▸ HSP90AA1 P07900 1/20 0.42
▸ PLAAT3 P53816 1/20 0.40
▸ PLAAT5 Q96KN8 1/20 0.40
▸ PLAAT2 Q9NWW9 1/20 0.40
▸ PLAAT4 Q9UL19 1/20 0.40

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
SCHEMBL15352178 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL16414630 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL5310822 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL1046537 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL2382177 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL16414852 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL16467630 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL1044964 0.98 CA2 (0.53) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL5515 0.93 TAAR1 (0.52) CA2TAAR1HTR2ACYP4A11CYP4F2
SCHEMBL242504 0.87 CA2 (0.61) CA2CYP4A11CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025235840-A1 ECHINOCANDIN-LIKE AND BORON-CONTAINING ECHINOCANDIN COMPOUNDS AND THEIR USE AS AGROCHEMICAL FUNGICIDES 5METIS, INC. (US) 2025-11-13 — — WO disclosed
US-12398168-B2 Preparation method of a glycoside compound SHANGHAI HUTCHISON PHARMACEUTICALS LIMITED (CN) 2025-08-26 — — US disclosed
EP-4140974-B1 METHODS OF IRON CATALYZED C-H BOND AMINATION VERSITECH LTD (CN) 2025-05-14 — — EP disclosed
US-12286426-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof Université de Montréal (CA) 2025-04-29 — — US disclosed
CN-118955244-A Method for preparing primary alcohol by homogeneously catalyzing and reducing carboxylic acid derivative by using N-heterocyclic carbene copper complex 延安大学 2024-11-15 — — CN disclosed
EP-3704111-B1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF UNIV MONTREAL (CA) 2024-10-09 — — EP disclosed
US-12098126-B2 Methods of iron catalyzed C-H bond amination VERSITECH LIMITED (CN) 2024-09-24 — — US disclosed
CN-112209908-B Glucopyranosyl derivatives and uses thereof 东莞市东阳光新药研发有限公司 2024-04-26 — — CN disclosed
CN-111886234-B Heterocyclic mitochondrial activity inhibitors and uses thereof 蒙特利尔大学 2023-12-15 — — CN disclosed
US-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF UNIV MONTREAL (CA) 2023-11-09 — — US disclosed
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PFIZER PHARMACEUTICALS INC. (JP) 2002-06-20 — — US disclosed
WO-2002032422-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 — — WO disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 — — WO disclosed
EP-1107944-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA 3 ADRENERGIC AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-20 — — EP disclosed
WO-2000012462-A1 AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA 3 ADRENERGIC AGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-03-09 — — WO disclosed
CN-1040321-C Pyran-2-ones and 5,6-dihydropyran-2-ones useful for treating HIV and other retroviruses UPJOHN CO (US) 1998-10-21 — — CN disclosed
EP-0668860-A1 PYRAN-2-ONES AND 5,6-DIHYDROPYRAN-2-ONES USEFUL FOR TREATING HIV AND OTHER RETROVIRUSES PHARMACIA & UPJOHN COMPANY (US) 1995-08-30 — — EP disclosed
EP-0247381-B1 5-FLUROROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-04 — — EP disclosed
US-5047521-A Anticarcinogenic agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 — — US disclosed
EP-0247381-A2 5-flurorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 — — 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 (5 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-20230357221-A1 HETEROCYCLIC MITOCHONDRIAL ACTIVITY INHIBITORS AND USES THEREOF IDH2, TFAM, IDH1 CA2 425/4885TAAR1 4509/4885HTR2A 4698/4885
US-12098126-B2 Methods of iron catalyzed C-H bond amination FTH1, FECH, HCCS CA2 1088/4885TAAR1 1185/4885HTR2A 1233/4885
US-12398168-B2 Preparation method of a glycoside compound GALE, ST6GAL1, MGAM CA2 1160/4885TAAR1 4827/4885HTR2A 3877/4885
US-20020077329-A1 EP4 receptor inhibitors to treat rheumatoid arthritis PTGER4, PTGER1, PTGER2 CA2 3323/4885TAAR1 493/4885HTR2A 853/4885
US-12286426-B2 Heterocyclic mitochondrial activity inhibitors and uses thereof IDH2, TFAM, IDH1 CA2 425/4885TAAR1 4509/4885HTR2A 4698/4885

“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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