SCHEMBL9690308

SCHEMBL9690308

N=C(N)Nc1ccc(C(=O)Oc2cccc(OC(=O)C3CCC3)c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
KMT2A Q03164 3/20 0.44
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 2/20 0.41
ELANE P08246 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PRSS1 P07477 5/20 0.40
ACR P10323 2/20 0.40
F10 P00742 4/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.39
F2 P00734 1/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39

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
SCHEMBL9689274 0.98 POLB (0.50) POLBL3MBTL1KMT2AUSP2SMN1; SMN2
SCHEMBL9690569 0.97 POLB (0.52) POLBL3MBTL1KMT2AUSP2SMN1; SMN2
SCHEMBL9688343 0.95 POLB (0.43) POLBKMT2AUSP2MAPTELANE
SCHEMBL9690353 0.89 SMN1; SMN2 (0.42) POLBL3MBTL1KMT2ASMN1; SMN2HTT
SCHEMBL9688325 0.87 KMT2A (0.42) POLBL3MBTL1KMT2AUSP2SMN1; SMN2
SCHEMBL9690546 0.86 SMN1; SMN2 (0.42) POLBKMT2AUSP2SMN1; SMN2HTT
SCHEMBL9689332 0.84 MEN1 (0.43) KMT2ASMN1; SMN2ELANEPRSS1ACR
SCHEMBL27690177 0.79 PARP10 (0.50) KMT2ASMN1; SMN2MAPTALDH1A1PRSS1
SCHEMBL9689323 0.79 KMT2A (0.39) L3MBTL1KMT2ASMN1; SMN2HTTTDP1
SCHEMBL9689610 0.79 F9 (0.47) KMT2APRSS1ACRMEN1

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
EP-0486702-A1 PHENYL 4-GUANIDINOBENZOATE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PROTEASE INHIBITOR CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1992-05-27 EP disclosed