SCHEMBL7953885

SCHEMBL7953885

CC(C)c1c[c]c2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
POLB P06746 2/20 0.34
ALDH1A1 P00352 5/20 0.33
NQO2 P16083 5/20 0.33
HPGD P15428 4/20 0.33
KDM4E B2RXH2 4/20 0.33
GLA P06280 3/20 0.33
CASP1 P29466 3/20 0.33
CASP7 P55210 3/20 0.33
MAOA P21397 2/20 0.33
ACHE P22303 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CHRM2 P08172 1/20 0.33
ADRA2A P08913 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33

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
SCHEMBL20304374 0.85 TDP1 (0.37) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL20264826 0.81 ALDH1A1 (0.39) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL96433 0.74 CYP1A2 (0.45) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL29089913 0.73 ELANE (0.40) MAPTALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL4875167 0.73 MAPT (0.46) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL4462883 0.69 MAPT (0.42) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL481985 0.69 ALDH1A1 (0.46) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL4462081 0.69 MAOA (0.46) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL6448214 0.69 MAPT (0.42) MAPTPOLBALDH1A1NQO2HPGD
SCHEMBL4477607 0.69 POLB (0.47) MAPTPOLBALDH1A1NQO2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5378711-A α-arylacrylates substituted by a heterocyclic radical, and fungicides which contain these compounds BASF AKTIENGESELLSCHAFT (DE) 1995-01-03 US claimed
US-6211190-B1 Pyrimidine derivatives, process and intermediate products for their preparation and pesticides or fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 2001-04-03 US disclosed
US-6200997-B1 CYCLIZATION TO GIVE OXAZOLIDINEDIONES AND TRIAZOLIDINEDIONES BASF AKTIENGESELLSCHAFT (DE) 2001-03-13 US disclosed
CN-1187814-A (hetero) aryloxy-, -thio-and-aminocrotonates, preparation and use thereof BASF AG (DE) 1998-07-15 CN disclosed
CN-1161687-A Phenylacetic acid alkyl esters BASF AG (DE) 1997-10-08 CN disclosed
US-5554578-A Oxime ether derivatives, their preparation and fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 1996-09-10 US disclosed
US-5468717-A Oxime ether derivatives, their preparation and fungicides containing these derivatives BASF AKTIENGESELLSCHAFT (DE) 1995-11-21 US disclosed
US-5334577-A 2-(substituted pyridy-oxymethyl)-phenylglyoxylate alkyloxime BASF AKTIENGESELLSCHAFT (DE) 1994-08-02 US disclosed
US-5051447-A Applying aromatic oximes to plants, seeds or soils BASF AKTIENGESELLSCHAFT (DE) 1991-09-24 US disclosed