SCHEMBL9867341

SCHEMBL9867341

COC(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccc(Br)cc12

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 3/20 0.73
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ KMT2A Q03164 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ PLA2G2A P14555 6/20 0.60
▸ KDM4E B2RXH2 3/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ RXFP1 Q9HBX9 1/20 0.53
▸ MAPT P10636 4/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ GAA P10253 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ P4HB P07237 1/20 0.51

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
SCHEMBL9867556 0.91 MEN1 (0.69) DHODHL3MBTL1KMT2AMEN1KDM4E
SCHEMBL1901514 0.84 PLA2G2A (0.73) DHODHL3MBTL1KMT2AMEN1PLA2G2A
SCHEMBL10440115 0.83 KMT2A (0.53) DHODHKMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL10440113 0.82 KMT2A (0.53) DHODHKMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL3937571 0.79 KDM4E (0.64) DHODHL3MBTL1KMT2AMEN1KDM4E
SCHEMBL15919505 0.79 EPRS1 (0.75) DHODHL3MBTL1KMT2AMEN1PLA2G2A
SCHEMBL27938966 0.79 PLA2G2A (0.78) DHODHL3MBTL1PLA2G2AKDM4EHSD17B10
SCHEMBL5792945 0.79 PLA2G2A (0.78) DHODHL3MBTL1KMT2AMEN1PLA2G2A
SCHEMBL7507266 0.77 KDM4E (0.70) DHODHKMT2AMEN1KDM4ESMN1; SMN2
SCHEMBL30690053 0.77 PLA2G2A (0.73) DHODHL3MBTL1KMT2AMEN1PLA2G2A

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-5071987-A Quinoline dyes; colorfastness BASF AKTIENGESELLSCHAFT (DE) 1991-12-10 — — US disclosed
Send feedback