SCHEMBL23959837

SCHEMBL23959837

O=C(OCC1CCOC1)C1CCC2OC2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.34
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
GABRP O00591 1/20 0.31
GABRD O14764 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB1 P18505 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
GABRB2 P47870 1/20 0.31
GABRA4 P48169 1/20 0.31
GABRE P78334 1/20 0.31
GABRA6 Q16445 1/20 0.31
GABRG1 Q8N1C3 1/20 0.31
GABRG3 Q99928 1/20 0.31
GABRQ Q9UN88 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
SCHEMBL15858092 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL13592587 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL17449256 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL17012023 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL14839282 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL681569 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL22239394 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL22486374 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL21710114 0.85 PPM1B (0.36) PPM1BPTPN1PPP1CCTP53CYP3A4
SCHEMBL26629791 0.84 PPM1B (0.32) PPM1BPTPN1PPP1CCTP53CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021213940-A1 USE OF INORGANIC SULPHITES AND/OR THIOSULPHATES FOR STABILISING ALIPHATIC POLYESTERS, STABILISED MOULDING COMPOSITIONS AND MOULDING COMPOSITIONS AND MOULDED PARTS PRODUCED THEREFROM Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2021-10-28 WO disclosed
WO-2021213939-A1 ADDITIVE COMPOSITION AND USE THEREOF, CONDENSATION POLYMER COMPOSITION, MOLDING COMPOUND AND MOLDING COMPOUNDS PRODUCED THEREFROM, AND MOLDED PARTS AND USE THEREOF Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2021-10-28 WO disclosed