SCHEMBL8876985

SCHEMBL8876985

CCCn1c(=O)oc2cc(F)c([N+](=O)[O-])cc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.40
KMO O15229 6/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
EGFR P00533 1/20 0.35
KMT2A Q03164 1/20 0.34
ESPL1 Q14674 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CD74 P04233 1/20 0.33
MIF P14174 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
SCHEMBL30690120 0.76 LMNA (0.44) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL19415673 0.71 KMO (0.71) IDO1KMOMAPTKMT2A
SCHEMBL8292029 0.69 GRIK1 (0.50)
SCHEMBL15323840 0.67 MAPT (0.76) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL15324212 0.67 MAPT (0.59) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL1027908 0.67 HTT (0.50) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL31451497 0.67 KMT2A (0.61) IDO1KMT2AALDH1A1CD74MIF
SCHEMBL31717113 0.67 GLS (0.44) KMOKDM4ELMNAMAPTHTT
SCHEMBL782891 0.66 SIGMAR1 (0.57) IDO1KMONPSR1KMT2AALDH1A1
SCHEMBL10913762 0.65 MAPT (0.47) KDM4ELMNAMAPTHTTNPSR1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5631209-A ALGICIDES ROHM AND HAAS COMPANY (US) 1997-05-20 US disclosed
US-5502027-A ALGICIDES ROHM AND HAAS COMPANY (US) 1996-03-26 US disclosed
US-5393735-A N-(halo-oxy-)phenyl substituted cyclic imides ROHM AND HAAS COMPANY (US) 1995-02-28 US disclosed
US-5238908-A HERBICIDAL GLUTARAMIC ACIDS AND DERIVATIVES ROHM AND HAAS COMPANY (US) 1993-08-24 US disclosed
EP-0415641-A1 Substituted glutaramic acids and derivatives ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed
EP-0415642-A1 Glutarimides ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed