SCHEMBL9809280

SCHEMBL9809280

COCCOc1ccc(CN)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.61
NFE2L2 Q16236 1/20 0.61
MAOB P27338 8/20 0.56
ST14 Q9Y5Y6 1/20 0.47
APP P05067 4/20 0.46
LTA4H P09960 1/20 0.44

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
SCHEMBL26659483 0.94 KEAP1 (0.56) KEAP1NFE2L2MAOBAPP
Hydrochloric Acid SCHEMBL26601051 0.93 MAOB (0.54) KEAP1NFE2L2MAOBAPP
SCHEMBL7973439 0.89 KEAP1 (0.67) KEAP1NFE2L2MAOBST14LTA4H
SCHEMBL8339774 0.84 MAPT (0.52) LTA4H
SCHEMBL6568884 0.84 TAAR1 (0.62) MAOB
SCHEMBL17321130 0.83 LTA4H (0.52) APPLTA4H
SCHEMBL7388158 0.82 KEAP1 (0.64) KEAP1NFE2L2MAOBST14LTA4H
SCHEMBL7988040 0.82 KEAP1 (0.64) KEAP1NFE2L2MAOBST14LTA4H
SCHEMBL2560922 0.81 MAOB (0.53) KEAP1NFE2L2MAOB
SCHEMBL873831 0.81 TAAR1 (0.48) MAOBLTA4H

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240139164-A1 RAPAMYCIN ANALOGS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-05-02 US disclosed
US-20240131012-A1 RAPAMYCIN ANALOGS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2024-04-25 US disclosed
CN-117529472-A GPR35 agonist compounds 赫普泰雅治疗有限公司 2024-02-06 CN disclosed
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-11819476-B2 Rapamycin analogs and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
EP-4069223-A1 RAPAMYCIN ANALOGS AND USES THEREOF Anakuria Therapeutics, Inc. (US) 2022-10-12 EP disclosed
US-20210186935-A1 RAPAMYCIN ANALOGS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 US disclosed
US-20210186935-A1 RAPAMYCIN ANALOGS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2021-06-24 US disclosed
WO-2021113665-A1 RAPAMYCIN ANALOGS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2021-06-10 WO disclosed
US-9585891-B2 Alpha hydroxy amides MERCK PATENT GMBH (DE) 2017-03-07 US disclosed
US-20150250792-A1 ALPHA HYDROXY AMIDES MERCK PATENT GMBH (DE) 2015-09-10 US disclosed
EP-2900633-A1 ALPHA HYDROXY AMIDES Merck Patent GmbH (DE) 2015-08-05 EP disclosed
EP-0276631-B1 WETTABLE SURFACE MODIFIED CONTACT LENS FABRICATED FROM AN OXIRANE CONTAINING HYDROPHOBIC POLYMER CIBA-GEIGY AG (CH) 1991-05-29 EP disclosed
EP-0276631-A1 Wettable surface modified contact lens fabricated from an oxirane containing hydrophobic polymer CIBA-GEIGY AG (CH) 1988-08-03 EP disclosed
US-4734475-A Wettable surface modified contact lens fabricated from an oxirane containing hydrophobic polymer CIBA-GEIGY CORPORATION (US) 1988-03-29 US disclosed
US-4634701-A Furan derivatives having anti-ulcer activity AUSONIA FARMACEUTICI S.R.L. (IT) 1987-01-06 US disclosed
EP-0164040-A2 Furan derivatives having anti-ulcer activity AUSONIA FARMACEUTICI S.r.l. (IT) 1985-12-11 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-20210186935-A1 RAPAMYCIN ANALOGS AND USES THEREOF RICTOR, MTOR, RPTOR KEAP1 1760/4885NFE2L2 4610/4885MAOB 4115/4885
US-20240139164-A1 RAPAMYCIN ANALOGS AND USES THEREOF RICTOR, MTOR, RPTOR KEAP1 1760/4885NFE2L2 4610/4885MAOB 4115/4885
US-20240131012-A1 RAPAMYCIN ANALOGS AND USES THEREOF RICTOR, MTOR, RPTOR KEAP1 1760/4885NFE2L2 4610/4885MAOB 4115/4885
US-11819476-B2 Rapamycin analogs and uses thereof RICTOR, MTOR, RPTOR KEAP1 937/4885NFE2L2 3995/4885MAOB 4268/4885
US-20150250792-A1 ALPHA HYDROXY AMIDES HCAR1, NAA40, HCAR2 KEAP1 924/4885NFE2L2 346/4885MAOB 1572/4885

“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.