SCHEMBL6662738

SCHEMBL6662738

O=C([O-])C1(C(=O)[O-])CCCCC1.O=C([O-])C1(C(=O)[O-])CCCCC1.O=C([O-])C1(C(=O)[O-])CCCCC1.[Mo+6]

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
CYP2C19 P33261 2/20 0.35
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
USP2 O75604 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
BLM P54132 1/20 0.34
CACNA2D1 P54289 1/20 0.34

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
Zinc Ion SCHEMBL28968544 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL28968493 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL28968537 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL8612559 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL2429027 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL28968520 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
Potassium Ion SCHEMBL28968517 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
Silver SCHEMBL21295179 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
SCHEMBL21295181 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2
Lithium Ion SCHEMBL28968511 0.94 CYP2C19 (0.32) TSHRCYP2C19ALDH1A1SMN1; SMN2USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727608-B1 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO LTD (JP) 2004-09-01 EP claimed
US-5862796-A Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1999-01-26 US claimed
EP-0727608-A2 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1996-08-21 EP claimed
EP-0727608-B1 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO LTD (JP) 2004-09-01 EP disclosed
US-5998647-A BIPHENYL DICARBOXYLIC ACID COPPER COMPLEX OSAKA GAS CO., LTD. (JP) 1999-12-07 US disclosed
US-5862796-A Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1999-01-26 US disclosed
EP-0727608-A2 Gas storage apparatus, gaseous fuel automobile using the gas storage apparatus, gas storage method and methane adsorbing-retaining agent OSAKA GAS CO., LTD. (JP) 1996-08-21 EP disclosed