SCHEMBL28630911

SCHEMBL28630911

CCN(CC)Cc1c(-c2ccccc2)nc2ccccn12

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.60
▸ RAB9A P51151 2/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ POLB P06746 1/20 0.60
▸ HTT P42858 1/20 0.60
▸ HDAC1 Q13547 6/20 0.55
▸ SLC2A1 P11166 2/20 0.52
▸ GABRA1 P14867 1/20 0.52
▸ GABRA5 P31644 1/20 0.52
▸ GABRB2 P47870 1/20 0.52
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ ADRA1B P35368 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47

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
SCHEMBL28630208 0.97 NPC1 (0.61) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28615473 0.91 NPC1 (0.60) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28616235 0.89 KDM4E (0.58) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28620514 0.89 NPC1 (0.59) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28622693 0.89 NPC1 (0.57) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28620849 0.87 NPC1 (0.60) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28622641 0.86 KDM4E (0.55) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28627525 0.85 RAB9A (0.54) NPC1RAB9ASMN1; SMN2KDM4EPOLB
SCHEMBL28624230 0.84 HDAC1 (0.60) NPC1RAB9ASMN1; SMN2KDM4EHDAC1
SCHEMBL28628801 0.82 NPC1 (0.60) NPC1RAB9ASMN1; SMN2KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118994144-A Imidazo pyridinium salt, preparation method thereof and application of electrochemiluminescence property thereof 湖南农业大学 2024-11-22 — — CN claimed
CN-118994144-A Imidazo pyridinium salt, preparation method thereof and application of electrochemiluminescence property thereof 湖南农业大学 2024-11-22 — — CN disclosed
CN-118994144-A Imidazo pyridinium salt, preparation method thereof and application of electrochemiluminescence property thereof 湖南农业大学 2024-11-22 — — CN disclosed
CN-113372346-B Synthetic method of 3-fatty amine methyl imidazo [1, 2-alpha ] pyridine compound 南华大学 2022-08-19 — — CN disclosed
CN-113372346-A Synthetic method of 3-fatty amine methyl imidazo [1, 2-alpha ] pyridine compound 南华大学 2021-09-10 — — CN disclosed
Send feedback