SCHEMBL9776402

SCHEMBL9776402

CCc1ccccc1-c1cc(C)ccc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
DHFR P00374 1/20 0.47
CSNK2A2 P19784 1/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CSNK2A3 Q8NEV1 1/20 0.42
KDM4E B2RXH2 2/20 0.41
S1PR4 O95977 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
GLA P06280 1/20 0.38
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
NQO1 P15559 1/20 0.37

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
SCHEMBL14496002 0.85 CSNK2A2 (0.50) ELANEDHFRCSNK2A2CSNK2BCSNK2A1
SCHEMBL8254791 0.83 DPP4 (0.48) ELANEDHFRCSNK2A2CSNK2BCSNK2A1
SCHEMBL5599467 0.81 CSNK2A2 (0.49) DHFRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL2176548 0.81 S1PR4 (0.41) ELANEKDM4ES1PR4L3MBTL1KMT2A
SCHEMBL14492841 0.81 ELANE (0.47) ELANEDHFRCSNK2A2CSNK2BCSNK2A1
SCHEMBL5953111 0.80 ELANE (0.39) ELANES1PR4KMT2AMEN1MAPT
SCHEMBL15455794 0.80 ELANE (0.39) ELANES1PR4KMT2AMEN1MAPT
SCHEMBL11875210 0.79 L3MBTL1 (0.45) KDM4EL3MBTL1KMT2AMAPTALDH1A1
SCHEMBL8409184 0.79 ELANE (0.46) ELANEDHFRCSNK2A2CSNK2BCSNK2A1
SCHEMBL277747 0.79 ELANE (0.52) ELANEDHFRS1PR4L3MBTL1KMT2A

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
US-5069991-A NAPHTHOLACTAM OR ISINDOLENINE DYE BASF AKTIENGESELLSCHAFT (DE) 1991-12-03 US disclosed
US-4906541-A Electrophotographic recording element containing a naphtholactam dye sensitizer BASF AKTIENGESELLSCHAFT (DE) 1990-03-06 US disclosed