SCHEMBL28836734

SCHEMBL28836734

C=C(c1ccccc1)n1nnc2ccc(C)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGAM O43451 8/20 0.50
▸ AMY1A P0DUB6 8/20 0.50
▸ GAA P10253 8/20 0.50
▸ SI P14410 8/20 0.50
▸ MGAM2 Q2M2H8 8/20 0.50
▸ KMT2A Q03164 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ F2 P00734 1/20 0.44
▸ SLC9A1 P19634 1/20 0.44
▸ KCNMA1 Q12791 1/20 0.42
▸ DGAT1 O75907 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ F12 P00748 2/20 0.37
▸ ADORA3 P0DMS8 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36

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
SCHEMBL28836689 0.88 KCNMA1 (0.54) MGAMAMY1AGAASIMGAM2
SCHEMBL29728235 0.88 KCNMA1 (0.54) MGAMAMY1AGAASIMGAM2
SCHEMBL29728226 0.82 MGAM (0.52) MGAMAMY1AGAASIMGAM2
SCHEMBL28836588 0.82 MGAM (0.52) MGAMAMY1AGAASIMGAM2
SCHEMBL29728230 0.81 MGAM (0.71) MGAMAMY1AGAASIMGAM2
SCHEMBL28836634 0.81 MGAM (0.71) MGAMAMY1AGAASIMGAM2
SCHEMBL28952648 0.81 GAA (0.65) MGAMAMY1AGAASIMGAM2
SCHEMBL29728232 0.81 GAA (0.65) MGAMAMY1AGAASIMGAM2
SCHEMBL29502834 0.76 MGAM (0.50) MGAMAMY1AGAASIMGAM2
SCHEMBL28581480 0.76 MGAM (0.50) MGAMAMY1AGAASIMGAM2

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-114874141-B Synthesis method for constructing phenanthridine compounds by ring-opening cyclization of alkenyl benzotriazole under catalysis of visible light 河南大学 2024-03-29 — — CN disclosed
CN-114874141-A Synthesis method for constructing phenanthridine compound through ring-opening cyclization of alkenyl benzotriazole under catalysis of visible light 河南大学 2022-08-09 — — CN disclosed
Send feedback