SCHEMBL329128

SCHEMBL329128

O=C(O)C1CCC(C(=O)O)CC1.O=C(O)C1CCC(C(=O)O)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
GABRP O00591 1/20 0.61
GABRD O14764 1/20 0.61
GABRA1 P14867 1/20 0.61
GABRB1 P18505 1/20 0.61
GABRG2 P18507 1/20 0.61
GABRB3 P28472 1/20 0.61
GABRA5 P31644 1/20 0.61
GABRA3 P34903 1/20 0.61
GABRA2 P47869 1/20 0.61
GABRB2 P47870 1/20 0.61
GABRA4 P48169 1/20 0.61
GABRE P78334 1/20 0.61
PMP22 Q01453 1/20 0.61
GABRA6 Q16445 1/20 0.61
GABRG1 Q8N1C3 1/20 0.61
GABRG3 Q99928 1/20 0.61
GABRQ Q9UN88 1/20 0.61
LMNA P02545 3/20 0.60
PLG P00747 1/20 0.60

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
Cyclopropane Carboxylic Acid SCHEMBL4643 1.00
SCHEMBL26833 1.00 TSHR (0.61) TSHRGABRPGABRDGABRA1GABRB1
Cyclopropane Carboxylic Acid SCHEMBL5499291 1.00
Cyclopropane Carboxylic Acid SCHEMBL32889332 1.00
Cyclopropane Carboxylic Acid SCHEMBL10800712 1.00
SCHEMBL196124 1.00 TSHR (0.61) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL36093 1.00 TSHR (0.61) TSHRGABRPGABRDGABRA1GABRB1
Cyclopropane Carboxylic Acid SCHEMBL15771700 0.96
SCHEMBL6662318 0.96 TSHR (0.58) TSHRGABRPGABRDGABRA1GABRB1
Hydrochloric Acid SCHEMBL2060066 0.96 TSHR (0.58) TSHRGABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115734868-A High temperature resistant thermal insulating laminate comprising aerogel layer 蓝移材料有限公司 2023-03-03 CN disclosed
EP-2407583-A1 LIQUID CRYSTAL POLYESTER FIBERS AND METHOD FOR PRODUCING THE SAME Toray Industries, Inc. (JP) 2012-01-18 EP disclosed
EP-0071447-A1 Polyester of 6-hydroxy-4-naphthoic acid, 4-hydroxy benzoic acid, 1-4-cyclohexanedicarboxylic acid, and aromatic diol capable of readily undergoing melt processing to form articles possessing high impact properties CELANESE CORPORATION (US) 1983-02-09 EP disclosed