SCHEMBL9765181

SCHEMBL9765181

O=C(NCCN1CCNC1=O)Nc1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.72
LMNA P02545 3/20 0.62
ALDH1A1 P00352 5/20 0.60
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
HTR3A P46098 1/20 0.51
FPR3 P25089 2/20 0.50
FPR2 P25090 2/20 0.50
POLB P06746 1/20 0.50
TSHR P16473 1/20 0.50
EPHX2 P34913 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
SCN9A Q15858 1/20 0.47

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
SCHEMBL11710148 0.87 CNR1 (0.62) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9753886 0.87 TSHR (0.66) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9765175 0.84 SMN1; SMN2 (0.60) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9765215 0.84 KDM4E (0.54) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9167791 0.80 KMT2A (0.60) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9765217 0.78 KDM4E (0.51) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL10018688 0.77 KDM4E (0.58) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL30415729 0.76 LMNA (1.00) KDM4ELMNAKMT2AHTR3ATSHR
SCHEMBL9765205 0.76 KDM4E (0.47) KDM4ELMNAALDH1A1RAB9AKMT2A
SCHEMBL9765206 0.76 KDM4E (0.47) KDM4ELMNAALDH1A1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001141-A N-(2-(2-oxo-1-imidazolidinyl)ethyl)-3-phenyl-urea and analogs as agents for induction of antioxidant enzymes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-19 US claimed
US-5001141-A N-(2-(2-oxo-1-imidazolidinyl)ethyl)-3-phenyl-urea and analogs as agents for induction of antioxidant enzymes E. I. DU PONT DE NEMOURS AND COMPANY (US) 1991-03-19 US disclosed