SCHEMBL979528

SCHEMBL979528

CC1CCC(=Cc2ccccc2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.53
MAPT P10636 4/20 0.50
CYP1A2 P05177 3/20 0.50
DYRK1A Q13627 3/20 0.50
DYRK1B Q9Y463 3/20 0.50
HPGD P15428 3/20 0.50
CLK1 P49759 2/20 0.50
F3 P13726 1/20 0.47
HTT P42858 1/20 0.46
PIK3CA P42336 1/20 0.44
DYRK2 Q92630 1/20 0.44
MAOB P27338 3/20 0.41
CA1 P00915 1/20 0.41
CA9 Q16790 1/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL981312 0.83 DYRK1A (0.69) ALDH1A1MAPTCYP1A2DYRK1ADYRK1B
SCHEMBL9047403 0.76 MAPT (0.61) ALDH1A1MAPTCYP1A2HPGDF3
SCHEMBL9048357 0.76 MAPT (0.61) ALDH1A1MAPTCYP1A2HPGDF3
SCHEMBL981606 0.74 CA1 (0.50) ALDH1A1MAPTDYRK1ADYRK1BHPGD
SCHEMBL19904768 0.74 CA1 (0.50) ALDH1A1MAPTDYRK1ADYRK1BHPGD
SCHEMBL3438471 0.73 ALDH1A1 (0.54) ALDH1A1MAPTCYP1A2HPGDF3
SCHEMBL3438472 0.73 ALDH1A1 (0.54) ALDH1A1MAPTCYP1A2HPGDF3
SCHEMBL21244821 0.73 CA1 (0.48) ALDH1A1MAPTDYRK1ADYRK1BHPGD
SCHEMBL3437937 0.70 HPGD (0.61) ALDH1A1MAPTCYP1A2HPGDF3
SCHEMBL8675213 0.70 HPGD (0.61) ALDH1A1MAPTCYP1A2HPGDF3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110014504-A1 LITHIUM SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2011-01-20 US disclosed
CN-100563056-C Lithium secondary battery MITSUBISHI CHEM CORP (JP) 2009-11-25 CN disclosed
US-20080311478-A1 Lithium Secondary Battery MITSUBISHI CHEMICAL CORPORATION (JP) 2008-12-18 US disclosed
CN-101203982-A Lithium secondary battery MITSUBISHI CHEM CORP (JP) 2008-06-18 CN disclosed
EP-1892789-A1 LITHIUM SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2008-02-27 EP disclosed