SCHEMBL12486124

SCHEMBL12486124

O=C(O)c1cc2ccccc2c2ccc3ccccc3c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
RXFP1 Q9HBX9 1/20 0.57
SOS1 Q07889 2/20 0.56
WDR5 P61964 1/20 0.55
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
LDHA P00338 1/20 0.53
ALDH1A1 P00352 5/20 0.51
HPGD P15428 5/20 0.51
LMNA P02545 1/20 0.51
KDM4E B2RXH2 3/20 0.50
GLA P06280 3/20 0.50
GPR35 Q9HC97 2/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 1/20 0.50
POLB P06746 1/20 0.50
HSD17B10 Q99714 3/20 0.48
CYP1A2 P05177 2/20 0.48

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
SCHEMBL6829025 0.85 NR4A1 (0.53) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL28356334 0.84 NR4A1 (0.60) MEN1KMT2ARXFP1SOS1WDR5
Hydrochloric Acid SCHEMBL4607669 0.83 NR4A1 (0.51) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL11879206 0.83 MEN1 (0.55) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL2088510 0.81 PTPN1 (0.57) MEN1KMT2ARXFP1SOS1ALDH1A1
SCHEMBL28555160 0.80 ALDH1A1 (0.59) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL522958 0.79 MEN1 (0.71) MEN1KMT2ARXFP1SOS1WDR5
SCHEMBL12486214 0.79 NR4A1 (0.63) MEN1KMT2ARXFP1SOS1WDR5
Phenanthrene SCHEMBL31651179 0.78 NR4A1 (0.75) MEN1KMT2ARXFP1SOS1WDR5
Phenanthrene SCHEMBL29265471 0.78 NR4A1 (0.75) MEN1KMT2ARXFP1SOS1WDR5

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-9790484-B2 Silica encapsulated biomaterials REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2017-10-17 US disclosed
US-20140051144-A1 SILICA ENCAPSULATED BIOMATERIALS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-02-20 US disclosed
WO-2012116013-A2 SILICA ENCAPSULATED BIOMATERIALS WACKETT LAWRENCE P (US) 2012-08-30 WO disclosed