SCHEMBL11550265

SCHEMBL11550265

COC(=O)NC(=N)NCC(OS(C)(=O)=O)c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC4R P32245 3/20 0.42
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 3/20 0.33
CXCL8 P10145 1/20 0.33
LMNA P02545 3/20 0.32
EEF2K O00418 2/20 0.32
C5AR1 P21730 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR2 P34972 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
SCHEMBL11549842 0.87 MC4R (0.33) MC4RKMT2ACXCL8SMN1; SMN2
SCHEMBL11553311 0.86 GLS (0.38) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11548090 0.86 CYP2C9 (0.35) MC4RALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11558084 0.85 AOC3 (0.38) MEN1KMT2AALDH1A1LMNA
SCHEMBL11493875 0.84 MC4R (0.43) MC4RMEN1KMT2AALDH1A1CXCL8
SCHEMBL11553042 0.80 CYP2C19 (0.38) MEN1KMT2A
SCHEMBL11550218 0.78 KMT2A (0.35) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL11549622 0.76 KCNA5 (0.36) ALDH1A1
SCHEMBL11486373 0.75 MC4R (0.34) MC4RKMT2AALDH1A1CXCL8LMNA
SCHEMBL11485460 0.72 CYP2C19 (0.36) MC4RALDH1A1LMNAMAPTSMN1; SMN2

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-4172204-A Method for preparing 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles and intermediates thereof SYNTEX (U.S.A.) INC. (US) 1979-10-23 US disclosed
EP-0001500-A1 1-Carbocyclic aryl-2-mono or -bis(alkoxycarbonyl) guanidino ethanes, and methods for their preparation and the preparation therefrom of 4,5-dihydro-2-alkoxycarbonylamino-5-carbocyclic aryl imidazoles SYNTEX (U.S.A.) INC. (US) 1979-04-18 EP disclosed