SCHEMBL27361848

SCHEMBL27361848

NC(=O)c1c(-c2ccccc2)c2ccccc2n1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 2/20 0.54
EDNRA P25101 2/20 0.54
CYP19A1 P11511 1/20 0.51
FOLH1 Q04609 1/20 0.51
MAPK8 P45983 1/20 0.51
SERPINE1 P05121 3/20 0.50
P2RX4 Q99571 1/20 0.50
HDAC6 Q9UBN7 4/20 0.49
HDAC1 Q13547 3/20 0.49
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PDE9A O76083 1/20 0.46
PDE1C Q14123 1/20 0.46
CCR2 P41597 2/20 0.46
USP2 O75604 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL23045524 0.85 KDM4E (0.46) EDNRBEDNRAMAPK8HDAC6HDAC1
SCHEMBL7744033 0.81 F10 (0.56) EDNRBEDNRACYP19A1FOLH1P2RX4
SCHEMBL29015820 0.78 FOLH1 (0.49) CYP19A1FOLH1P2RX4KDM4EMEN1
SCHEMBL5419800 0.78 SERPINE1 (0.66) EDNRBEDNRAFOLH1MAPK8SERPINE1
SCHEMBL27361847 0.78 KDM4E (0.62) KDM4EALDH1A1MAPTMAPK1
SCHEMBL8856902 0.77 EDNRB (0.58) EDNRBEDNRAFOLH1MAPK8SERPINE1
SCHEMBL19133588 0.77 EDNRB (0.59) EDNRBEDNRACYP19A1FOLH1SERPINE1
SCHEMBL6017853 0.76 SMN1; SMN2 (0.53) KDM4EALDH1A1KMT2AMAPTSMN1; SMN2
SCHEMBL5415705 0.76 MAPK8 (0.52) MAPK8HDAC6HDAC1KDM4EMEN1
SCHEMBL5424000 0.76 SERPINE1 (0.62) EDNRBEDNRAFOLH1MAPK8SERPINE1

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
CN-1067886-A New urea derivatives, their preparation method and pharmaceutical composition thereof FUJISAWA PHARMACEUTICAL CO (JP) 1993-01-13 CN disclosed