SCHEMBL9847824

SCHEMBL9847824

Nc1cc(F)c(Cl)cc1N(C(=O)CCl)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
MITF O75030 2/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PAX8 Q06710 1/20 0.42
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
NCOA1 Q15788 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
HSD11B1 P28845 4/20 0.33
TACR1 P25103 2/20 0.33
AKR1B1 P15121 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 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
SCHEMBL9847873 0.89 HSD11B1 (0.33) SMN1; SMN2MITFALDH1A1NPC1RAB9A
SCHEMBL9847843 0.83 LMNA (0.38) SMN1; SMN2ALDH1A1NPC1RAB9AKDM4E
SCHEMBL2217683 0.72 SLC6A4 (0.39) KMT2ASLC6A4
SCHEMBL22289618 0.69 MITF (0.60) SMN1; SMN2MITFALDH1A1NPC1RAB9A
SCHEMBL30884762 0.68 ALDH1A1 (0.44) SMN1; SMN2MITFALDH1A1RAB9AMEN1
SCHEMBL5176983 0.68 ALDH1A1 (0.44) SMN1; SMN2MITFALDH1A1RAB9AMEN1
SCHEMBL20521218 0.66 SLC6A4 (0.36) SMN1; SMN2ALDH1A1KDM4EMEN1KMT2A
SCHEMBL26660405 0.66 ALDH1A1 (0.39) SMN1; SMN2MITFALDH1A1NPC1RAB9A
SCHEMBL19953554 0.65 ALDH1A1 (0.84) SMN1; SMN2MITFALDH1A1NPC1RAB9A
SCHEMBL5993915 0.64 ALDH1A1 (0.66) SMN1; SMN2MITFALDH1A1NPC1RAB9A

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