SCHEMBL1323089

SCHEMBL1323089

PCC(C1CCCCC1)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.55
SHBG P04278 1/20 0.42
TP53 P04637 3/20 0.41
LMNA P02545 3/20 0.41
CYP2D6 P10635 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
TSHR P16473 1/20 0.41
MLNR O43193 1/20 0.41
ABCB11 O95342 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
HTR1A P08908 1/20 0.41
CHRM5 P08912 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL1323184 0.97 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1324078 0.78 EPHX1 (0.50) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL9821330 0.75 EPHX1 (0.60) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1323171 0.74 EPHX1 (0.46) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1324498 0.74 EPHX1 (0.46) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL17529723 0.72 EPHX1 (0.44) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL1324529 0.71 EPHX1 (0.48) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL6518166 0.71 EPHX1 (0.55) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL11730380 0.71 EPHX1 (0.43) EPHX1SHBGTP53LMNACYP2D6
SCHEMBL17529700 0.71 EPHX1 (0.43) EPHX1SHBGTP53LMNACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1502605-B Preparation of polyisocyanates containing uretidione groups BAYER AG 2010-10-13 CN claimed
CN-1502605-A Prepartion of polyisocyanates containing uretdione groups 2004-06-09 CN claimed
US-12492281-B2 Polyisocyanurate materials as electrical potting compounds COVESTRO DEUTSCHLAND AG (DE) 2025-12-09 US disclosed
WO-2024098840-A1 ISOBUTYLENE-BASED CATIONIC SALT POLYMER, PREPARATION METHOD THEREFOR, USE THEREOF, AND ANTIBACTERIAL POLYMER MATERIAL 中国石油化工股份有限公司 2024-05-16 WO disclosed
CN-112204065-B Process for preparing polyisocyanate polymers and polyisocyanurate plastics 科思创知识产权两合公司 2023-03-28 CN disclosed
CN-109642015-B Method for producing polyisocyanurate plastics by means of phosphine catalysis 科思创德国股份有限公司 2022-09-23 CN disclosed
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
US-11319402-B2 Method for producing a polyisocyanate polymer and a polyisocyanurate plastic COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-05-03 US disclosed
US-20220127407-A1 POLYISOCYANURATE MATERIALS AS ELECTRICAL POTTING COMPOUNDS COVESTRO DEUTSCHLAND AG (DE) 2022-04-28 US disclosed
US-11279790-B2 Process for producing polyisocyanurate plastics by means of phosphine catalysis COVESTRO DEUTSCHLAND AG (DE) 2022-03-22 US disclosed
EP-3507321-B1 PROCESS FOR PRODUCING POLYISOCYANURATE PLASTICS BY MEANS OF PHOSPHINE CATALYSIS COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2022-03-02 EP disclosed
US-6034286-A CATALYTIC REACTING ALKADIENE WITH CARBON MONOXIDE AND HYDROGEN UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 2000-03-07 US disclosed
EP-0900184-A1 PROCESSES FOR PRODUCING 1,6-HEXANEDIOLS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1999-03-10 EP disclosed
EP-0872482-A2 Process for producing epsilon caprolactones and/or hydrates and/or esters thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-10-21 EP disclosed
US-5817883-A HYDROCARBONYLATION AND HYDROFORMYLATION OF ALKADIENES OR HYDROCARBONYLATION OF PENTANALS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-10-06 US disclosed
WO-1997039998-A1 PROCESSES FOR PRODUCING 1,6-HEXANEDIOLS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-10-30 WO disclosed
WO-1997040000-A1 PROCESSES FOR PRODUCING HYDROXYALDEHYDES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-10-30 WO disclosed
WO-1997039995-A1 PROCESSES FOR PRODUCING UNSATURATED ALCOHOLS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-10-30 WO disclosed
US-4595701-A Reacting carbon monoxide and hydrogen in liquid phase in the presence of a rhodium and trialkylphosphine catalyst AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1986-06-17 US disclosed
US-4065511-A REACTING ORGANIC PEROXIDES AND A TRIHYDROCARBYL PHOSPHINE PHILLIPS PETROLEUM (US) 1977-12-27 US disclosed