SCHEMBL25052839

SCHEMBL25052839

CN1CCNC[C@H]1c1cc(F)ccc1F

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 6/20 0.49
HTR2A P28223 2/20 0.49
KDM1A O60341 2/20 0.40
KDM1B Q8NB78 1/20 0.40
HTR2B P41595 4/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
JAK2 O60674 1/20 0.36
NTRK1 P04629 1/20 0.36

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
SCHEMBL4306200 1.00 HTR2C (0.49) HTR2CHTR2AKDM1AKDM1BHTR2B
SCHEMBL18782895 0.86 HTR2C (0.44) HTR2CHTR2AHTR2BCHRNB2CHRNB4
SCHEMBL11034439 0.81 HTR2C (0.49) HTR2CHTR2AHTR2B
SCHEMBL4102416 0.81 HTR2C (0.46) HTR2CHTR2AKDM1AKDM1BHTR2B
SCHEMBL18950390 0.81 HTR2C (0.46) HTR2CHTR2AKDM1AKDM1BHTR2B
SCHEMBL25053363 0.81 HTR2C (0.46) HTR2CHTR2AKDM1AKDM1BHTR2B
SCHEMBL4294177 0.80 KDM1A (0.44) KDM1AKDM1BJAK2NTRK1
SCHEMBL20016164 0.80 KDM1A (0.44) KDM1AKDM1BJAK2NTRK1
SCHEMBL21400027 0.78 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4JAK2
SCHEMBL21400030 0.78 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4JAK2

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
WO-2022200523-A9 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2023-02-16 WO disclosed