SCHEMBL10401445

SCHEMBL10401445

NC1=NNC(=O)C1=NOCc1ccccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
IDO1 P14902 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.39
PKM P14618 1/20 0.39
MPO P05164 2/20 0.38
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP12 P39900 1/20 0.35
PTPN1 P18031 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.33
PNMT P11086 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
PNP P00491 1/20 0.33
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33

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
SCHEMBL10401121 0.81 USP8 (0.39) MAPTIDO1L3MBTL1PKMMPO
SCHEMBL17986311 0.64 IDO1 (0.57) MAPTIDO1L3MBTL1PKMKMT2A
SCHEMBL10642416 0.63 MAPT (0.47) MAPTIDO1L3MBTL1PKMMMP1
Hydrochloric Acid SCHEMBL9262935 0.60 MAPT (0.44) MAPTIDO1L3MBTL1PKMMPO
SCHEMBL9366433 0.60 IDO1 (1.00) IDO1PNMT
SCHEMBL10341599 0.60 IDO1 (0.55) MAPTIDO1L3MBTL1MMP1MMP2
SCHEMBL3774965 0.59 IDO1 (0.67) MAPTIDO1PKMPNMTLMNA
SCHEMBL8762708 0.59 IDO1 (0.67) IDO1PKMPNMTLMNANR4A2
SCHEMBL17986304 0.59 IDO1 (0.50) MAPTIDO1L3MBTL1PKMKMT2A
SCHEMBL17986306 0.59 IDO1 (0.50) MAPTIDO1L3MBTL1PKMKMT2A

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-4968714-A APPLICATION TO PLANTS, SEEDS, SOILS BAYER AKTIENGESELLSCHAFT (DE) 1990-11-06 US claimed