SCHEMBL7575587

SCHEMBL7575587

CNc1cccc(C(=O)O)c1NC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLCN2 P51788 1/20 0.49
KDM4E B2RXH2 4/20 0.48
POLB P06746 2/20 0.48
ATM Q13315 1/20 0.48
FABP4 P15090 3/20 0.46
FABP3 P05413 1/20 0.46
FABP5 Q01469 1/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
MMP14 P50281 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
PTGS2 P35354 2/20 0.46
AKR1C3 P42330 2/20 0.46
HIF1A Q16665 2/20 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
SCHEMBL3644862 0.87 ALDH1A1 (0.52) CLCN2KDM4EPOLBMAPTMAPK1
SCHEMBL6236190 0.84 CLCN2 (0.50) CLCN2KDM4EPOLBATMFABP4
SCHEMBL6236192 0.84 CLCN2 (0.50) CLCN2KDM4EPOLBATMFABP4
SCHEMBL27955677 0.83 KMT2A (0.54) KDM4EPOLBATMMAPTKMT2A
SCHEMBL1260742 0.82 KDM4E (0.47) CLCN2KDM4EPOLBATMFABP4
N-Methylanthranilic Acid SCHEMBL29381752 0.81 KDM4E (0.64) CLCN2KDM4EPOLBATMFABP4
N-Methylanthranilic Acid SCHEMBL130356 0.81 KDM4E (0.64) CLCN2KDM4EPOLBATMFABP4
SCHEMBL7308406 0.80 TSHR (0.59) CLCN2KDM4EPOLBFABP4FABP3
SCHEMBL1681296 0.80 CA12 (0.54) CLCN2KDM4EPOLBMAPTMAPK1
SCHEMBL856314 0.80 NPC1 (0.57) KDM4EPOLBATMMAPTSMN1; SMN2

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
EP-1047368-B1 PROCESS FOR TREATING HARD TISSUES MINNESOTA MINING & MFG (US) 2002-07-31 EP disclosed
US-4288541-A MERCURY LIGAND COMPLEXING AGENT FOR DETERMINATION OF GLUCOSE IN URINE MILES LABORATORIES, INC. (US) 1981-09-08 US disclosed