Cyclopropane

Cyclopropane

SCHEMBL9107519

C1CC1.Cc1ccc(NC(=O)Nc2cccc3c2ccn3Cc2ccnc(NC(=O)O)c2)cc1Cl

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 1/20 0.43
NR1I2 O75469 1/20 0.42
MAPT P10636 4/20 0.42
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
BRAF P15056 1/20 0.40
NPC1 O15118 1/20 0.40
NTRK1 P04629 1/20 0.40
NTRK2 Q16620 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CDK5 Q00535 1/20 0.40
DYRK1A Q13627 1/20 0.40
CDK5R1 Q15078 1/20 0.40
STING1 Q86WV6 1/20 0.39

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
SCHEMBL5592598 0.92 SMN1; SMN2 (0.48) MEN1KMT2AKDM4ERAB9ANR1I2
SCHEMBL9885248 0.91 KDR (0.46) MEN1KMT2AKDM4ERAB9AMAPT
SCHEMBL5592625 0.87 CDK8 (0.44) MEN1KMT2AKDM4ERAB9ANR1I2
SCHEMBL5592573 0.86 MEN1 (0.49) MEN1KMT2AKDM4ERAB9ANR1I2
SCHEMBL5586121 0.86 BRAF (0.47) MEN1KMT2AKDM4ERAB9ANR1I2
Cyclopropane SCHEMBL9108474 0.83 MEN1 (0.46) MEN1KMT2AKDM4ERAB9AMAPT
Cyclopropane SCHEMBL9104235 0.79 EPHB4 (0.43) MEN1KMT2AKDM4EMAPTTP53
SCHEMBL5586117 0.78 MAPT (0.42) MEN1KMT2AMAPTTHRATHRB
Cyclopropane SCHEMBL9107860 0.78 BRAF (0.43) THRATHRBBRAF
Cyclopropane SCHEMBL9104865 0.78 KDR (0.45) MEN1KMT2AKDM4EMAPTTP53

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