SCHEMBL25899949

SCHEMBL25899949

CCc1cc(O)ccc1C(=O)Nc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.56
RAB9A P51151 6/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
RXFP1 Q9HBX9 1/20 0.54
KDM4E B2RXH2 2/20 0.54
GAA P10253 2/20 0.54
ALDH1A1 P00352 1/20 0.54
GLA P06280 1/20 0.54
POLB P06746 1/20 0.54
MAPT P10636 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KCNMA1 Q12791 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
TP53 P04637 1/20 0.52
SORT1 Q99523 1/20 0.52
SGMS2 Q8NHU3 1/20 0.51
CHRNB2 P17787 1/20 0.50
CHRNB4 P30926 1/20 0.50
CHRNA3 P32297 1/20 0.50

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
SCHEMBL2726850 0.84 MEN1 (0.65) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL11729468 0.83 NPC1 (0.58) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL2269809 0.83 NPC1 (0.69) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL27792368 0.80 KCNMA1 (0.74) NPC1RAB9AMEN1KMT2AKDM4E
2-Aminopyridine SCHEMBL9806564 0.76 NPC1 (0.60) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL25900021 0.76 SMN1; SMN2 (0.52) NPC1RAB9ARXFP1KDM4EL3MBTL1
SCHEMBL9725157 0.76 NPC1 (0.68) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL31175268 0.75 MEN1 (0.53) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL31175266 0.75 MEN1 (0.53) NPC1RAB9AMEN1KMT2ARXFP1
SCHEMBL20610223 0.75 SORT1 (0.68) NPC1RAB9AMEN1KMT2AKDM4E

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-4215524-A1 COMPOUND SERVING AS THYROID HORMONE BETA RECEPTOR AGONIST AND USES OF COMPOUND Sunshine Lake Pharma Co., Ltd. (CN) 2023-07-26 EP disclosed