SCHEMBL14129686

SCHEMBL14129686

Cc1ccc(N=Cc2cnc(C)nc2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.48
MAPT P10636 5/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HPGD P15428 2/20 0.48
ALDH1A1 P00352 6/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 1/20 0.45
ADRA2A P08913 3/20 0.44
ADRA2B P18089 3/20 0.44
ADRA2C P18825 3/20 0.44
PLAU P00749 1/20 0.44
CCR1 P32246 1/20 0.38
CCR5 P51681 1/20 0.38
CCR8 P51685 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
PKM P14618 1/20 0.36
NOS3 P29474 1/20 0.35
NOS2 P35228 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
SCHEMBL14129679 0.85 KDM4E (0.50) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL14129667 0.83 KDM4E (0.46) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL14129561 0.78 ALDH1A1 (0.51) KDM4EMAPTMEN1KMT2AALDH1A1
SCHEMBL14129681 0.76 KDM4E (0.30) KDM4EMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL14728791 0.72 PKM (0.54) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL14129004 0.72 KDM4E (0.52) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL1356191 0.70 ADRA2A (0.47) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL1356192 0.70 ADRA2A (0.47) KDM4EMAPTMEN1KMT2AHPGD
SCHEMBL11706620 0.70
Hydrochloric Acid SCHEMBL11707885 0.69 ADRA2A (0.57) KDM4EMAPTMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7393598-B2 Light emitting molecules and organic light emitting devices including light emitting molecules HCF PARTNERS, L.P. (US) 2008-07-01 US disclosed