SCHEMBL3285292

SCHEMBL3285292

CCCCCCCC(P)(C1C2CC3CC(C2)CC1C3)C1C2CC3CC(C2)CC1C3

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.38
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 1/20 0.31
THRB P10828 1/20 0.31
GGPS1 O95749 1/20 0.31
CNR2 P34972 7/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL3282752 1.00 EPHX2 (0.38) EPHX2NPSR1TSHRTHRBGGPS1
SCHEMBL2410122 0.86 L3MBTL1 (0.32) EPHX2L3MBTL1
Iodide SCHEMBL1478381 0.84 L3MBTL1 (0.32) EPHX2L3MBTL1
SCHEMBL1324023 0.75 CNR2 (0.30) CNR2
SCHEMBL1337496 0.73
SCHEMBL1323177 0.68 CYP1A2 (0.40) EPHX2TSHRTHRBGGPS1
SCHEMBL7712675 0.67 EPHX2 (0.42) EPHX2NPSR1TSHRTHRBL3MBTL1
SCHEMBL29210028 0.67 CYP1A2 (0.43) EPHX2
SCHEMBL29210040 0.67 CYP1A2 (0.43) EPHX2
SCHEMBL17529699 0.67 CYP1A2 (0.43) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3794049-B1 METHOD FOR PRODUCING A POLYISOCYANATE POLYMER AND A POLYISOCYANURATE PLASTIC COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-06-08 EP disclosed
EP-3931185-A1 POLYISOCYANURATE MATERIALS AS ELECTRICAL POTTING COMPOUNDS Covestro Intellectual Property GmbH & Co. KG (DE) 2022-01-05 EP disclosed
EP-3794049-A1 METHOD FOR PRODUCING A POLYISOCYANATE POLYMER AND A POLYISOCYANURATE PLASTIC Covestro Intellectual Property GmbH & Co. KG (DE) 2021-03-24 EP disclosed
EP-3794050-A1 METHOD FOR PREPARING COMPOSITE MATERIALS MADE OF POLYETHYLENE FIBERS HAVING AN ULTRA-HIGH MOLECULAR WEIGHT AND CROSS-LINKED POLYISOCYANATES Covestro Intellectual Property GmbH & Co. KG (DE) 2021-03-24 EP disclosed
US-7709680-B2 Preparation of polyisocyanates containing uretdione groups using phosphine catalysts BAYER MATERIALSCIENCE AG (DE) 2010-05-04 US disclosed
US-20080262262-A1 Preparation of polyisocyanates containing uretdione groups using phosphine catalysts BAYER MATERIALSCIENCE AG 2008-10-23 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 (1 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-20080262262-A1 Preparation of polyisocyanates containing uretdione groups using phosphine catalysts PPIP5K2, IPMK, INPP5B EPHX2 2018/4885NPSR1 1606/4885TSHR 4316/4885

“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.