SCHEMBL10511751

SCHEMBL10511751

O=[N+]([O-])c1ccc[c]c1-c1ccc(O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.44
TDP1 Q9NUW8 5/20 0.44
MAPT P10636 3/20 0.44
GAA P10253 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK1 P28482 2/20 0.44
PKM P14618 1/20 0.44
ALDH1A1 P00352 4/20 0.38
BACE1 P56817 1/20 0.38
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
HPGD P15428 1/20 0.37
ERN1 O75460 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RECQL P46063 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HSD17B10 Q99714 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
SCHEMBL28405351 0.86 TDP1 (0.44) GPR35TDP1MAPTMEN1KMT2A
SCHEMBL7499271 0.85 APP (0.42) GPR35TDP1MAPTMEN1KMT2A
SCHEMBL4375603 0.84 ALDH1A1 (0.53) GPR35TDP1MEN1KMT2AMAPK1
SCHEMBL27636988 0.83 TDP1 (0.41) GPR35TDP1MAPTGAAMEN1
SCHEMBL41322 0.74 GPR35 (0.54) GPR35TDP1MAPTGAAMEN1
SCHEMBL14880715 0.74 TSHR (0.48) TDP1MAPTGAAMEN1KMT2A
SCHEMBL1206907 0.74 ALDH1A1 (0.53) GPR35TDP1GAAMEN1KMT2A
SCHEMBL4649696 0.73 EIF4E (0.39) GPR35TDP1MAPTMEN1KMT2A
SCHEMBL8138795 0.73 ALDH1A1 (0.45) GPR35TDP1MAPTGAAMEN1
SCHEMBL27376059 0.73 GPR35 (0.57) GPR35TDP1MAPTGAAMEN1

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-4877808-A ANTITHROMBOTICS FOURNIER INNOVATION ET SYNERGIE (FR) 1989-10-31 US disclosed