SCHEMBL18196201

SCHEMBL18196201

O=C(O)c1cc2cc3ccccc3cc2c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
RXFP1 Q9HBX9 1/20 0.56
IDO1 P14902 1/20 0.53
HPGD P15428 4/20 0.52
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 4/20 0.52
HSD17B10 Q99714 3/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 2/20 0.52
NR4A1 P22736 1/20 0.52
NR4A2 P43354 1/20 0.52
NR4A3 Q92570 1/20 0.52
GLA P06280 1/20 0.52
GPR35 Q9HC97 2/20 0.49
POLB P06746 1/20 0.49
WDR5 P61964 1/20 0.48
TP53 P04637 1/20 0.47
HIF1A Q16665 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL9612531 0.86 ALDH1A1 (0.47) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL522958 0.86 MEN1 (0.71) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL5371348 0.84 MEN1 (0.54) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL471867 0.83 KDM4E (0.55) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL22229836 0.80 NR4A1 (0.73) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL28555160 0.79 ALDH1A1 (0.59) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL1825309 0.79 CDC25B (0.58) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL1355689 0.79 PTPN1 (0.51) MEN1KMT2ARXFP1IDO1HPGD
SCHEMBL19999156 0.79 HPGD (0.57) MEN1KMT2ARXFP1HPGDALDH1A1
SCHEMBL69728 0.79 IDO1 (0.65) MEN1KMT2ARXFP1IDO1HPGD

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
US-20160326393-A1 NONCOVALENT BOND-MODIFIED CARBON STRUCTURE, AND CARBON STRUCTURE/POLYMER COMPOSITE COMPRISING SAME POSCO (KR) 2016-11-10 US disclosed
US-20160326393-A1 NONCOVALENT BOND-MODIFIED CARBON STRUCTURE, AND CARBON STRUCTURE/POLYMER COMPOSITE COMPRISING SAME POSCO (KR) 2016-11-10 US disclosed
EP-3088356-A1 NONCOVALENT BOND-MODIFIED CARBON STRUCTURE, AND CARBON STRUCTURE/POLYMER COMPOSITE COMPRISING SAME Posco (KR) 2016-11-02 EP disclosed