SCHEMBL28634259

SCHEMBL28634259

Clc1ccc(-n2ccnc2-c2cnccn2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.41
GRM5 P41594 1/20 0.38
KCNH2 Q12809 1/20 0.38
ALDH1A1 P00352 1/20 0.37
HCAR1 Q9BXC0 1/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
PIEZO1 Q92508 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 1/20 0.35
TERT O14746 2/20 0.35

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
SCHEMBL28636867 0.90 P2RX7 (0.39) P2RX7ALDH1A1RAB9ANPC1PIEZO1
SCHEMBL28923906 0.78 P2RX7 (0.43) P2RX7ALDH1A1HCAR1RAB9ANPC1
SCHEMBL8047156 0.71 HCAR1 (0.42) KCNH2HCAR1NPC1SMN1; SMN2MAPT
SCHEMBL6074928 0.71 RAB9A (0.48) GRM5ALDH1A1RAB9ANPC1PIEZO1
SCHEMBL5406690 0.68 NOTUM (0.41) GRM5RAB9ANPC1PIEZO1SMN1; SMN2
SCHEMBL5173711 0.68 IDO1 (0.49) KCNH2HCAR1POLBMEN1LMNA
SCHEMBL30767271 0.67 IDO1 (0.50) P2RX7RAB9ANPC1PIEZO1MAPT
SCHEMBL3948151 0.67 IDO1 (0.50) P2RX7RAB9ANPC1PIEZO1MAPT
SCHEMBL27604626 0.66 RAB9A (0.42) P2RX7ALDH1A1RAB9ANPC1PIEZO1
SCHEMBL27987583 0.66 IDO1 (0.49) ALDH1A1GABRA2

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-113234062-B Pyrazinylimidazole compound, weldable protective agent, preparation method and application of pyrazinylimidazole compound and weldable protective agent 赣州市贝加尔电子材料有限公司 2022-07-08 CN disclosed
CN-113234062-A Pyrazinylimidazole compound, weldable protective agent, preparation method and application of pyrazinylimidazole compound and weldable protective agent 赣州市贝加尔电子材料有限公司 2021-08-10 CN disclosed