SCHEMBL6650409

SCHEMBL6650409

Cn1ccnc1Cc1ccc(C(O)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
FDPS P14324 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 1/20 0.33
CYP2D6 P10635 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
SCHEMBL6650689 0.85 L3MBTL1 (0.40) L3MBTL1MEN1KMT2AKDM4EMAPT
SCHEMBL21721828 0.83 HTR1D (0.43) L3MBTL1MEN1KMT2AOPRK1FDPS
SCHEMBL6651872 0.75 LMNA (0.36) L3MBTL1MEN1KMT2AKDM4EOPRK1
SCHEMBL1044189 0.75 KMT2A (0.54) MEN1KMT2AKDM4EMAPTFDPS
SCHEMBL27475942 0.74 MEN1 (0.41) MEN1KMT2AOPRK1FDPSSMN1; SMN2
SCHEMBL1044399 0.74 NR4A1 (0.46) L3MBTL1MEN1KMT2AKDM4EMAPT
Hydrochloric Acid SCHEMBL1875423 0.74 KMT2A (0.53) MEN1KMT2AKDM4EMAPTFDPS
SCHEMBL6650490 0.72 MEN1 (0.37) L3MBTL1MEN1KMT2AKDM4EMAPT
Ethylene SCHEMBL28111857 0.72 KMT2A (0.51) L3MBTL1MEN1KMT2AKDM4EMAPT
SCHEMBL4063363 0.72 FDPS (0.48) MEN1KMT2AKDM4EOPRK1FDPS

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-1103243-B1 UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES FOR THE TREATMENT OF TROUBLES MEDIATED BY AN EXCESS OF SUBSTANCE P ESTEVE LABOR DR (ES) 2004-01-07 EP claimed