SCHEMBL169759

SCHEMBL169759

O=C(c1ccc[nH]1)c1c(O)c2ccccc2n1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
FOLH1 Q04609 2/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
RECQL P46063 1/20 0.41
MAPK1 P28482 1/20 0.36
PPARG P37231 1/20 0.35
PGR P06401 1/20 0.35
CCND3 P30281 1/20 0.35
CDK6 Q00534 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
KDR P35968 1/20 0.35

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
SCHEMBL170978 0.83 KMT2A (0.51) KMT2AFOLH1KDM4EALDH1A1CYP1A2
SCHEMBL11421766 0.76 KMT2A (0.54) KMT2AFOLH1KDM4EALDH1A1CYP1A2
SCHEMBL9537285 0.71 MAPK8 (0.56) KMT2AFOLH1KDM4EALDH1A1CYP1A2
SCHEMBL169758 0.70 AGTR1 (0.48) KMT2AKDM4EALDH1A1HPGDCYP2C19
SCHEMBL170605 0.68 TP53 (0.46) KMT2AKDM4EALDH1A1HPGDRECQL
SCHEMBL11415985 0.68 KDM4E (0.47) KMT2AFOLH1KDM4EALDH1A1CYP1A2
SCHEMBL1074961 0.67 ALDH1A1 (0.56) ALDH1A1CYP1A2L3MBTL1ATMCCND3
SCHEMBL6579776 0.66 KMT2A (0.71) KMT2AFOLH1KDM4EALDH1A1CYP1A2
SCHEMBL371069 0.66 TSHR (0.54) KMT2AKDM4ECYP1A2ATMCCND3
SCHEMBL11038273 0.66 EDNRA (0.57) KMT2AFOLH1KDM4EALDH1A1PPARG

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-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed