SCHEMBL30040120

SCHEMBL30040120

Cc1ccc2nc(-c3ccccc3)c(Cc3ccc(N(C)C)cc3)n2c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 5/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ KDM4E B2RXH2 2/20 0.50
▸ GABRA1 P14867 2/20 0.50
▸ GABRB2 P47870 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ ALB P02768 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CHRM1 P11229 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ GABRB1 P18505 1/20 0.50
▸ GABRG2 P18507 1/20 0.50
▸ GABRB3 P28472 1/20 0.50
▸ GABRA3 P34903 1/20 0.50
▸ ADRA1A P35348 1/20 0.50
▸ OPRK1 P41145 1/20 0.50
▸ HTR2B P41595 1/20 0.50
▸ GABRA2 P47869 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ HSD17B10 Q99714 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
SCHEMBL30039667 0.84 SMN1; SMN2 (0.52) SMN1; SMN2KDM4EGABRA1GABRB2SLC2A1
SCHEMBL30038776 0.83 MAPT (0.61) SMN1; SMN2KDM4EGABRA1GABRB2LMNA
SCHEMBL30039361 0.82 SMN1; SMN2 (0.54) SMN1; SMN2KDM4EALDH1A1NPC1RAB9A
SCHEMBL30040900 0.77 TP53 (0.44) SMN1; SMN2KDM4ELMNACYP3A4SLC2A1
SCHEMBL30040911 0.77 KDM4E (0.45) SMN1; SMN2KDM4EGABRA1GABRB2GABRA2
SCHEMBL30040895 0.76 GAA (0.52) KDM4ECYP3A4HPGDHSD17B10ALDH1A1
SCHEMBL30039601 0.75 MAPT (0.59) SMN1; SMN2KDM4EALDH1A1HTTNPSR1
SCHEMBL30039276 0.75 ALDH1A1 (0.51) SMN1; SMN2KDM4EGABRA1GABRB2HPGD
SCHEMBL30040119 0.75 KDM4E (0.67) SMN1; SMN2KDM4EGABRA1GABRB2SLC2A1
SCHEMBL30040108 0.75 AKT1 (0.45) SMN1; SMN2KDM4EALDH1A1RAB9A

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-115261896-B Synthesis method of 4' -alkylamino benzyl-3-imidazo [1,2-a ] pyridine derivative 深圳职业技术学院 2024-08-30 — — CN disclosed
CN-115261896-A Synthesis method of 4' -alkylaminobenzyl-3-imidazo [1,2-a ] pyridine derivative 深圳职业技术学院 2022-11-01 — — CN disclosed
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