1,3-Butanediol

1,3-Butanediol

SCHEMBL587367

CC(O)CCO.O=C(O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of 1,3-Butanediol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.41
GABRP O00591 2/20 0.40
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
GABRE P78334 2/20 0.40
GABRA6 Q16445 2/20 0.40
GABRG1 Q8N1C3 2/20 0.40
GABRG3 Q99928 2/20 0.40
GABRQ Q9UN88 2/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 2/20 0.37

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
1,3-Butanediol SCHEMBL29094771 0.92 TDP1 (0.40) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL9486917 0.92 TDP1 (0.40) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL2195943 0.92 TDP1 (0.40) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL27552678 0.92 TDP1 (0.40) TDP1ALDH1A1GABRPGABRDGABRA1
Lactic Acid SCHEMBL10632947 0.89 TP53 (0.58) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL11041309 0.89 TP53 (0.43) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL27943842 0.88 TDP1 (0.42) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL3376246 0.88 ALDH1A1 (0.34) TDP1ALDH1A1GABRPGABRDGABRA1
1,3-Butanediol SCHEMBL222874 0.87
1,3-Butanediol SCHEMBL3427715 0.87 TDP1 (0.53) TDP1ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635620-B1 METHOD FOR PRODUCING POLYCARBONATE POLYOLS BY THE IMMORTAL POLYMERIZATION OF CYCLIC CARBONATES COVESTRO DEUTSCHLAND AG (DE) 2016-06-08 EP claimed
US-9260562-B2 Method for producing polycarbonate polyols by the immortal polymerization of cyclic carbonates BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-02-16 US claimed
US-20140018517-A1 METHOD FOR PRODUCING POLYCARBONATE POLYOLS BY THE IMMORTAL POLYMERIZATION OF CYCLIC CARBONATES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-16 US claimed
US-7049387-B2 Cure accelerator system for phenolic resins GEORGIA-PACIFIC RESINS, INC. (US) 2006-05-23 US claimed
US-20030071393-A1 Cure accelerator system for phenolic resins JPMORGAN CHASE BANK, N.A. 2003-04-17 US claimed
EP-1302489-A1 Cure accelerator system for phenolic resins GEORGIA-PACIFIC CORPORATION (US) 2003-04-16 EP claimed
EP-0469785-B1 Retarders for curing/hardening resole resins BORDEN INC (US) 1995-01-11 EP claimed
US-5096983-A Magnesium oxide and and ester as hardeners, retarder to inhibit hardening BORDEN, INC. (US) 1992-03-17 US claimed
EP-0469785-A2 Retarders for curing/hardening resole resins Borden, Inc. (US) 1992-02-05 EP claimed
EP-0050811-B1 PROCESS FOR PREPARING ANIONIC COPOLYMERISATES FROM CYCLIC CARBONIC-ACID ESTERS AND LACTAMS, AND THEIR USE BAYER AG (DE) 1985-02-13 EP claimed
EP-4709778-A1 PROCESSES FOR PREPARING A MIXTURE THAT CONTAINS A POLYOXYALKYLENE POLYOL Covestro Deutschland AG (DE) 2026-03-18 EP disclosed
US-12515174-B2 Articles including an isoporous membrane disposed on a porous substrate and methods of making the same SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2026-01-06 US disclosed
WO-2024231371-A1 PROCESSES FOR PREPARING A MIXTURE THAT CONTAINS A POLYOXYALKYLENE POLYOL COVESTRO DEUTSCHLAND AG (DE) 2024-11-14 WO disclosed
EP-4461762-A1 METHOD FOR PRODUCING A MIXTURE CONTAINING A POLYOXYALKYLENE POLYOL; MIXTURE AND COMPONENTS OBTAINED FROM THE METHOD Covestro Deutschland AG (DE) 2024-11-13 EP disclosed
US-12060454-B2 Process for the continuous production of polyoxyalkylene polyols COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2024-08-13 US disclosed
EP-0336534-A1 Compositions for foundry molding processes utilizing reclaimed sand ACME RESIN CORPORATION (US) 1989-10-11 EP disclosed
EP-0336533-A2 Process to enhance the tensile strength of reclaimed sand bonded with ester cured alkaline phenolic resin BORDEN, INC. (US) 1989-10-11 EP disclosed
US-4862948-A Phenolic resin adhesive pastes, assemblies prepared therefrom, and processes for preparing cast metal articles using these pastes BORDEN, INC. (US) 1989-09-05 US disclosed
EP-0259042-A2 Process for bonding lignocellulosic material Borden, Inc. (US) 1988-03-09 EP disclosed
US-4431795-A Copolymers of cyclic carbonic acid esters and lactams and their production BAYER AKTIENGESELLSCHAFT (DE) 1984-02-14 US disclosed