SCHEMBL1786723

SCHEMBL1786723

CCCCCCNC(=O)CCCCCC

nearest known ligand 0.83

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CASP2 P42575 1/20 0.83
▸ FAAH O00519 4/20 0.78
▸ NAAA Q02083 1/20 0.77
▸ DNM1 Q05193 2/20 0.72
▸ EPHX2 P34913 3/20 0.69
▸ SLC6A5 Q9Y345 2/20 0.67
▸ EPHX1 P07099 4/20 0.64
▸ HSP90AA1 P07900 1/20 0.61

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
SCHEMBL819566 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL10790501 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL22271678 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL2150966 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL8368632 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL498043 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL23775006 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21234011 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL20542645 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2
SCHEMBL21633848 1.00 CASP2 (0.83) CASP2FAAHNAAADNM1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117279880-A Process for producing cycloalkyl bromide 住友化学株式会社 2023-12-22 — — CN disclosed
EP-3830093-A1 BIFUNCTIONAL COMPOUNDS AS CDK MODULATORS Biotheryx, Inc. (US) 2021-06-09 — — EP disclosed
WO-2021081677-A1 CHIRAL GUANIDINES, SALTS THEREOF, METHODS OF MAKING CHIRAL GUANIDINES AND SALTS THEREOF, AND USES OF CHIRAL GUANIDINES AND SALTS THEREOF IN THE PREPARATION OF ENANTIOMERICALLY PURE AMINO ACIDS FU RUI (CA) 2021-05-06 — — WO disclosed
WO-2021013693-A1 ANTIBODY DRUG CONJUGATES (ADCS) WITH NAMPT INHIBITORS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2021-01-28 — — WO disclosed
WO-2020023782-A1 BIFUNCTIONAL COMPOUNDS AS CDK MODULATORS BIOTHERYX, INC. (US) 2020-01-30 — — WO disclosed
US-9884132-B2 Homomultivalent and heteromultivalent inhibitors of prostate specific membrane antigen (PSMA) and uses thereof THE JOHNS HOPKINS UNIVERSITY (US) 2018-02-06 — — US disclosed
US-20150368281-A1 Platinum Compounds Of Malonic Acid Derivative Having Leaving Group Containing Amino Or Alkylamino BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT CO., LTD (CN) 2015-12-24 — — US disclosed
EP-2925715-A1 METHOD FOR PRODUCING FORMIC ACID BASF SE (DE) 2015-10-07 — — EP disclosed
EP-2924044-A1 PLATINUM COMPOUND OF MALONIC ACID DERIVATIVE HAVING LEAVING GROUP CONTAINING AMINO OR ALKYLAMINO BEIJING FSWELCOME TECHNOLOGY DEVELOPMENT, CO., LTD (CN) 2015-09-30 — — EP disclosed
EP-1864977-B1 NOVEL CYCLIC COMPOUND HAVING PYRIMIDINYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO LTD (JP) 2015-07-29 — — EP disclosed
WO-2013092157-A1 PROCESS FOR PREPARING FORMIC ACID BASF SE (DE) 2013-06-27 — — WO disclosed
WO-2013092403-A1 METHOD FOR PRODUCING FORMIC ACID BASF SE (DE) 2013-06-27 — — WO disclosed
US-20110124646-A1 Novel cyclic compound having pyrimidinylalkylthio group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-05-26 — — US disclosed
US-7906511-B2 Cyclic compound having pyrimidinylalkylthio group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-03-15 — — US disclosed
US-20090291951-A1 Novel Cyclic Compound Having Pyrimidinylalkylthio Group SATEN PHARMACEUTICAL CO., LTD. (JP) 2009-11-26 — — US disclosed
EP-1864977-A1 NOVEL CYCLIC COMPOUND HAVING PYRIMIDINYLALKYLTHIO GROUP SANTEN PHARMACEUTICAL CO., LTD. (JP) 2007-12-12 — — EP disclosed
EP-1667519-A1 SURFACTANT/SOLVENT MIXTURES Bayer CropScience GmbH (DE) 2006-06-14 — — EP disclosed
WO-2005036962-A1 SURFACTANT/SOLVENT MIXTURES BAYER CROPSCIENCE GMBH (DE) 2005-04-28 — — WO disclosed
WO-2002000622-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-03 — — WO disclosed
EP-0513285-A1 IMIDAZOL-2-YL DERIVATIVES OF SUBSTITUTED BICYCLIC COMPOUNDS AND PROCESS FOR THEIR PREPARATION. ERBA CARLO SPA (IT) 1992-11-19 — — 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 (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-20090291951-A1 Novel Cyclic Compound Having Pyrimidinylalkylthio Group AGTR1, AGTR2, ARRB1 CASP2 2775/4885FAAH 3328/4885NAAA 894/4885
US-20150368281-A1 Platinum Compounds Of Malonic Acid Derivative Having Leaving Group Containing Amino Or Alkylamino SLC7A1, ME3, SLC7A5 CASP2 3481/4885FAAH 4686/4885NAAA 2341/4885
US-20110124646-A1 Novel cyclic compound having pyrimidinylalkylthio group FLT1, VEGFA, FLT4 CASP2 1866/4885FAAH 2489/4885NAAA 3003/4885

“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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