SCHEMBL31498236

SCHEMBL31498236

CC(C)Nc1nnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ LMNA P02545 2/20 0.61
▸ GAA P10253 2/20 0.61
▸ KDM4E B2RXH2 1/20 0.61
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ POLB P06746 1/20 0.53
▸ KCNH3 Q9ULD8 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ ADORA2A P29274 3/20 0.47
▸ ADORA1 P30542 3/20 0.47
▸ GPR84 Q9NQS5 2/20 0.47
▸ ACP1 P24666 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ NUDT1 P36639 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
SCHEMBL2323756 0.79 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL31582421 0.79 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL11108867 0.76 GAA (1.00) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL18614739 0.70 CKS1B (0.49) SMN1; SMN2LMNAMEN1KMT2AKCNH3
SCHEMBL31582535 0.70 POLB (0.67) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL11272208 0.70 GAA (0.60) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL2321152 0.70 GPR84 (0.55) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL22606143 0.69 KCNH3 (0.42) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL31582295 0.69 KCNH3 (0.54) SMN1; SMN2ALDH1A1LMNAGAAKDM4E
SCHEMBL31582291 0.69 POLB (0.65) SMN1; SMN2ALDH1A1LMNAGAAKDM4E

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-119775219-A Diphenyl triazine compound intermediate, and synthetic method and application thereof 河北国龙制药有限公司 2025-04-08 — — CN claimed
CN-119775219-A Diphenyl triazine compound intermediate, and synthetic method and application thereof 河北国龙制药有限公司 2025-04-08 — — CN disclosed
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