SCHEMBL8883000

SCHEMBL8883000

CCCOC(=O)CNC(=O)c1ncccc1OC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CTSA P10619 1/20 0.44
EGLN2 Q96KS0 1/20 0.43
FTO Q9C0B1 1/20 0.43
PTPN1 P18031 1/20 0.42
HTT P42858 3/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.40
ADORA2A P29274 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL968780 0.94 KMT2A (0.51) MEN1KMT2ACTSAEGLN2FTO
SCHEMBL8883325 0.93 MEN1 (0.50) MEN1KMT2ACTSAEGLN2FTO
SCHEMBL964994 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL969853 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL7206287 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL8882071 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL964996 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL8883981 0.92 PTPN1 (0.49) MEN1KMT2ACTSAPTPN1HTT
Hydrochloric Acid SCHEMBL966022 0.91 PTPN1 (0.48) MEN1KMT2ACTSAPTPN1HTT
SCHEMBL8135880 0.85 EGLN2 (0.62) EGLN2FTOHTTPOLBLMNA

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-5658933-A Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals HOECHST AKTIENGESELLSCHAFT (DE) 1997-08-19 US disclosed