SCHEMBL28339131

SCHEMBL28339131

NC1(N)C=CC(C(=O)Nc2cccc(Cl)c2)=CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
FADS1 O60427 3/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 2/20 0.48
HTT P42858 2/20 0.48
ALDH1A1 P00352 2/20 0.48
GRM5 P41594 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GRM4 Q14833 2/20 0.46
P2RX1 P51575 1/20 0.46
P2RX4 Q99571 1/20 0.46
P2RX7 Q99572 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
AHR P35869 2/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL28879787 0.85 MEN1 (0.50) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL1413121 0.84 PTPN1 (0.44) RAB9AMEN1KMT2ALMNAHTT
SCHEMBL28337052 0.80 KMT2A (0.44) MEN1MAPTKMT2ALMNA
SCHEMBL28669837 0.72 MGLL (0.37) RAB9AMAPTALDH1A1HSD17B10
SCHEMBL27495602 0.69 POLB (0.41) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL3675463 0.68 KCNK3 (0.84) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL167193 0.67 MEN1 (0.71) NPC1RAB9AFADS1MEN1MAPT
SCHEMBL2682054 0.67 KMT2A (1.00) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL4255341 0.67 NPC1 (0.81) NPC1RAB9AFADS1MEN1MAPT
SCHEMBL3794687 0.67 NPC1 (1.00) NPC1RAB9AMEN1MAPTKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110628025-B Polyimide precursor, polyimide, and material for use in production thereof 宇部兴产株式会社 2022-07-12 CN disclosed
CN-110628025-A Polyimide precursor, polyimide, and material for use in preparation thereof 宇部兴产株式会社 2019-12-31 CN disclosed