SCHEMBL30040895

SCHEMBL30040895

Cc1cccn2c(Cc3ccc(N(C)C)cc3)c(-c3ccccc3)nc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ KDM4E B2RXH2 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ GLA P06280 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ CYP3A4 P08684 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ RAD51 Q06609 1/20 0.43
▸ AKT1 P31749 1/20 0.41
▸ AKT2 P31751 1/20 0.41

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 0.81 SMN1; SMN2 (0.52) GAAALDH1A1KDM4ENPC1RAB9A
SCHEMBL30039361 0.78 SMN1; SMN2 (0.54) GAAALDH1A1KDM4ENPC1RAB9A
SCHEMBL30038776 0.76 MAPT (0.61) GAAALDH1A1KDM4ENPC1HPGD
SCHEMBL30040120 0.76 NR1H4 (0.57) ALDH1A1KDM4ENPC1HPGDRAB9A
SCHEMBL30040911 0.74 KDM4E (0.45) ALDH1A1KDM4ENPC1RAB9AAKT1
SCHEMBL30040119 0.73 KDM4E (0.67) GAAALDH1A1KDM4ENPC1RAB9A
SCHEMBL30039276 0.73 ALDH1A1 (0.51) GAAALDH1A1KDM4ENPC1HPGD
SCHEMBL30039601 0.73 MAPT (0.59) GAAALDH1A1KDM4ENPC1RAB9A
SCHEMBL30040900 0.72 TP53 (0.44) GAAALDH1A1KDM4ENPC1RAB9A
SCHEMBL13325912 0.72 GAA (0.71) GAAALDH1A1KDM4ENPC1GLA

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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