Cyclopropane

Cyclopropane

SCHEMBL9108474

C1CC1.COc1ccc(Cl)cc1NC(=O)Nc1cccc2c1ccn2Cc1ccnc(NC(=O)O)c1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
POLB P06746 2/20 0.46
IGF1R P08069 3/20 0.45
EPHB4 P54760 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
ALOX12 P18054 1/20 0.42
GAA P10253 1/20 0.42
THRB P10828 1/20 0.42
NTRK1 P04629 1/20 0.41
NTRK2 Q16620 1/20 0.41

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
SCHEMBL5585966 0.91 MEN1 (0.48) MEN1KMT2APOLBIGF1REPHB4
Cyclopropane SCHEMBL9104235 0.91 EPHB4 (0.43) MEN1KMT2AEPHB4MAPTKDM4E
SCHEMBL9885353 0.90 MEN1 (0.45) MEN1KMT2APOLBIGF1REPHB4
Cyclopropane SCHEMBL9104865 0.89 KDR (0.45) MEN1KMT2AEPHB4MAPTKDM4E
SCHEMBL5600303 0.88 MEN1 (0.45) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL5959777 0.88 MEN1 (0.45) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL5592576 0.88 MEN1 (0.46) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL5592585 0.86 MEN1 (0.47) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL5959896 0.86 MEN1 (0.46) MEN1KMT2APOLBIGF1REPHB4
SCHEMBL5600048 0.86 MEN1 (0.57) MEN1KMT2APOLBIGF1REPHB4

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
EP-1858879-B1 1,3-DIARYL SUBSTITUTED UREAS AS MODULATORS OF KINASE ACTIVITY GILEAD CONNECTICUT INC (US) 2012-06-06 EP claimed