SCHEMBL7274885

SCHEMBL7274885

COC(=O)CCc1ccc(-n2c(C)cn(-c3ccc(C(=N)NC(=O)OC)cc3)c2=O)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
RPS6KA3 P51812 1/20 0.33
IDO1 P14902 1/20 0.33
LSS P48449 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
PTPN1 P18031 2/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL7274977 0.94 KMT2A (0.38) LMNAL3MBTL1ALDH1A1TDP1ADRB2
SCHEMBL7281961 0.88 ITGB3 (0.44) LMNAL3MBTL1MAPT
Hydrochloric Acid SCHEMBL7281573 0.87 ITGB3 (0.43)
Hydrochloric Acid SCHEMBL7286391 0.86 ITGB3 (0.42)
SCHEMBL7282163 0.85 PTPN1 (0.37) LMNAL3MBTL1ALDH1A1TDP1ADRB2
SCHEMBL7271729 0.83 RXRA (0.38) ADRB2ADRB1MAPTMEN1GAA
SCHEMBL7281878 0.80 CYP11B1 (0.46) LMNAALDH1A1TDP1ADRB2ADRB1
SCHEMBL7275527 0.80 CYP11B1 (0.46) LMNAALDH1A1TDP1ADRB2ADRB1
SCHEMBL7280890 0.80 RPS6KA3 (0.36) ADRB2ADRB1RPS6KA3HRH3PTPN1
SCHEMBL7273615 0.79 F2 (0.43) LMNAL3MBTL1ALDH1A1TDP1RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650424-A ANTIAGGLOMERANTS USING IMIDAZOLIDINDIONES DR. KARL THOMAE GMBH (DE) 1997-07-22 US disclosed
EP-0503548-B1 Cyclic urea derivatives, medicaments contaning them and process for their preparation THOMAE GMBH DR K (DE) 1997-06-04 EP disclosed
EP-0503548-A1 Cyclic urea derivatives, medicaments contaning them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-16 EP disclosed