SCHEMBL485498

SCHEMBL485498

CC1=CC(=O)C=C(C(C)(C)C)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.45
ATM Q13315 4/20 0.45
ALDH1A1 P00352 4/20 0.45
PKM P14618 2/20 0.45
HPGD P15428 2/20 0.45
MPI P34949 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
MCL1 Q07820 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.33
DDAH1 O94760 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
USP2 O75604 2/20 0.31
TP53 P04637 2/20 0.31
CYP3A4 P08684 2/20 0.31
MAPK1 P28482 2/20 0.31
PLIN1 O60240 1/20 0.31
NR1I2 O75469 1/20 0.31

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
SCHEMBL853674 0.85 MAPT (0.52) MAPTATMALDH1A1PKMHPGD
Methane SCHEMBL21391655 0.82 ATM (0.50) MAPTATMALDH1A1PKMHPGD
SCHEMBL4751533 0.81 ATM (0.45) MAPTATMALDH1A1PKMHPGD
SCHEMBL14673579 0.81 ATM (0.45) MAPTATMALDH1A1PKMHPGD
SCHEMBL12677688 0.81 ATM (0.45) MAPTATMALDH1A1PKMHPGD
SCHEMBL19074432 0.77 ALDH1A1 (0.42) MAPTATMALDH1A1PKMHPGD
SCHEMBL21463 0.76 MAPT (0.41) MAPTATMALDH1A1PKMHPGD
SCHEMBL15893572 0.76 ATM (0.41) MAPTATMALDH1A1PKMHPGD
SCHEMBL18403093 0.76 ATM (0.41) MAPTATMALDH1A1PKMHPGD
SCHEMBL13780434 0.76 ATM (0.41) MAPTATMALDH1A1PKMHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2023-11-02 US disclosed
US-11767334-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2023-09-26 US disclosed
US-9777024-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2017-10-03 US disclosed
EP-2411446-B2 PROCESS FOR PREPARING UNSATURATED POLYESTER DSM IP ASSETS BV (NL) 2017-09-13 EP disclosed
US-20160137672-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2016-05-19 US disclosed
US-9221843-B2 Heteroaryl inhibitors of PDE4 Tetra Discovery Partners, LLC (US) 2015-12-29 US disclosed
US-20150119362-A1 HETEROARYL INHIBITORS OF PDE4 Tetra Discovery Partners, LLC 2015-04-30 US disclosed
EP-2411446-B1 PROCESS FOR PREPARING UNSATURATED POLYESTER DSM IP ASSETS BV (NL) 2014-06-25 EP disclosed
US-20120101226-A1 PROCESS FOR PREPARING UNSATURATED POLYESTER DSM IP ASSETS B.V. (NL) 2012-04-26 US disclosed
EP-2411446-A1 PROCESS FOR PREPARING UNSATURATED POLYESTER DSM IP Assets B.V. (NL) 2012-02-01 EP disclosed
WO-2010108968-A1 PROCESS FOR PREPARING UNSATURATED POLYESTER DSM IP ASSETS B.V. (NL) 2010-09-30 WO disclosed
EP-0445827-B1 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO KK (JP) 1996-09-25 EP disclosed
US-5149834-A Anticholesterol agent and enzyme inhibitors, for curing arteriosclerosis FUJIREBIO INC. (JP) 1992-09-22 US disclosed
EP-0445827-A2 4-Hydroxytetrahydropyran-2-one derivatives useful as cholesterol and lipid reducing agents FUJIREBIO INC. (JP) 1991-09-11 EP disclosed
US-3935247-A COBALT OR COPPER PHTHALOCYANINE CATALYST THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-01-27 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-20150119362-A1 HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C MAPT 4329/4885ATM 2713/4885ALDH1A1 751/4885
US-20230348501-A1 HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C MAPT 4241/4885ATM 2972/4885ALDH1A1 1152/4885
US-11767334-B2 Heteroaryl inhibitors of PDE4 PDE4A, PDE4B, PDE4C MAPT 4241/4885ATM 2972/4885ALDH1A1 1152/4885
US-20160137672-A1 HETEROARYL INHIBITORS OF PDE4 PDE4A, PDE4B, PDE4C MAPT 4329/4885ATM 2713/4885ALDH1A1 751/4885

“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.