SCHEMBL9847843

SCHEMBL9847843

CC(=O)N(c1cc(Cl)c(F)cc1N)C1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
HSD11B1 P28845 3/20 0.35
AKR1B1 P15121 2/20 0.34
KDM4E B2RXH2 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
TDP2 O95551 1/20 0.33
S1PR4 O95977 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
XBP1 P17861 1/20 0.33
S1PR1 P21453 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
PAX8 Q06710 1/20 0.33
MCL1 Q07820 1/20 0.33

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
SCHEMBL9847824 0.83 SMN1; SMN2 (0.42) LMNAHSD11B1AKR1B1KDM4ENPC1
SCHEMBL9847873 0.83 HSD11B1 (0.33) HSD11B1AKR1B1KDM4ENPC1RAB9A
SCHEMBL9847872 0.79 GPR174 (0.37) LMNAKDM4ENPC1MAPTMAPK1
SCHEMBL9847871 0.76 KDM4E (0.35) LMNAHSD11B1KDM4EAPAF1NPC1
SCHEMBL9847870 0.74 ALDH1A1 (0.43) KDM4EAPAF1NPC1TDP2S1PR4
SCHEMBL20521218 0.71 SLC6A4 (0.36) AKR1B1KDM4EMAPTMAPK1L3MBTL1
SCHEMBL30638941 0.65 FSCN1 (0.51) LMNANPC1MAPTHTTRAB9A
SCHEMBL26122228 0.65 KMT2A (0.43) ALDH1A1KMT2ASLC6A4
SCHEMBL9847904 0.64 HSD11B1 (0.40) HSD11B1S1PR1OPRM1SLC6A4
SCHEMBL2216477 0.64 MAPT (0.34) LMNAMAPTMAPK1RAB9APAX8

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-0430847-A1 Procedure for the preparation of N-cyclopropyl-4-fluoroanilines CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) 1991-06-05 EP disclosed