SCHEMBL29693614

SCHEMBL29693614

c1ccc2[nH]c(-c3ccncc3)nc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 1.00
ALDH1A1 P00352 8/20 1.00
PKN1 Q16512 1/20 1.00
PKN2 Q16513 1/20 1.00
NPC1 O15118 7/20 0.75
RAB9A P51151 7/20 0.75
GAA P10253 2/20 0.75
SMN1; SMN2 Q16637 6/20 0.67
HSD17B10 Q99714 5/20 0.67
PKM P14618 3/20 0.67
TP53 P04637 2/20 0.67
LDHA P00338 1/20 0.67
EPHX2 P34913 1/20 0.67
ABCB11 O95342 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
HPGD P15428 6/20 0.66
MAPT P10636 3/20 0.66
POLB P06746 1/20 0.66
GFER P55789 1/20 0.66
ALOX15 P16050 1/20 0.60

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
SCHEMBL695990 1.00 KDM4E (1.00) KDM4EALDH1A1PKN1PKN2NPC1
Pyridine SCHEMBL28089196 0.89 NPC1 (0.82) KDM4EALDH1A1PKN1PKN2NPC1
SCHEMBL29386825 0.88 NPC1 (0.88) KDM4EALDH1A1PKN1PKN2NPC1
SCHEMBL2178266 0.88 NPC1 (0.88) KDM4EALDH1A1PKN1PKN2NPC1
Hydrochloric Acid SCHEMBL2148025 0.86 NPC1 (0.92) KDM4EALDH1A1PKN1PKN2NPC1
Hydrochloric Acid SCHEMBL2147086 0.86 NPC1 (0.92) KDM4EALDH1A1PKN1PKN2NPC1
SCHEMBL24295036 0.86 NPC1 (0.84) KDM4EALDH1A1PKN1PKN2NPC1
Benzene SCHEMBL28005151 0.86 NPC1 (1.00) KDM4EALDH1A1PKN1PKN2NPC1
SCHEMBL105095 0.86 NPC1 (1.00) KDM4EALDH1A1PKN1PKN2NPC1
SCHEMBL30440947 0.85 KDM4E (0.73) KDM4EALDH1A1PKN1PKN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118727076-A Cyanide-free plating solution suitable for preparing silver plating layer with double crystal structure, and preparation method and application thereof 上海电力大学 2024-10-01 CN claimed
CN-118727076-A Cyanide-free plating solution suitable for preparing silver plating layer with double crystal structure, and preparation method and application thereof 上海电力大学 2024-10-01 CN disclosed
CN-117567431-A Benzimidazole compound, preparation method thereof and organic weldable protective agent 深圳市贝加电子材料有限公司 2024-02-20 CN disclosed
CN-116783168-A Electrochromic compounds and optical articles comprising the same 依视路国际公司 2023-09-19 CN disclosed
WO-2022136020-A1 ELECTROCHROMIC COMPOUNDS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2022-06-30 WO disclosed
CN-112004845-B Resin composition, laminate, semiconductor wafer with resin composition layer, substrate, and semiconductor device 三菱瓦斯化学株式会社 2022-05-31 CN disclosed