SCHEMBL28464447

SCHEMBL28464447

CCOc1ccc2[nH]c3c(c2c1)CN(C(=O)O)CC3

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 8/20 0.64
▸ LMNA P02545 1/20 0.62
▸ PABPC1 P11940 1/20 0.62
▸ ATM Q13315 1/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.62
▸ RAD52 P43351 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ KDR P35968 1/20 0.55
▸ CFTR P13569 6/20 0.54
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ ACHE P22303 1/20 0.52

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
SCHEMBL29171356 0.87 BAZ2B (0.82) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL21114766 0.86 LMNA (0.62) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL8228026 0.86 BAZ2B (0.57) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL7132310 0.81 LMNA (0.68) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL12868564 0.81 LMNA (0.78) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL3424575 0.81 BAZ2B (0.81) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL3477871 0.78 BAZ2B (0.79) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL29171353 0.78 BAZ2B (0.79) BAZ2BSMN1; SMN2KMT2ACFTRKDM4E
SCHEMBL28475633 0.78 BAZ2B (0.79) BAZ2BLMNAPABPC1ATMSMN1; SMN2
SCHEMBL5372790 0.78 BAZ2B (0.67) BAZ2BLMNAKDRCFTRALOX15

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-111757882-B Compounds for treating, alleviating or preventing conditions associated with tau aggregates AC免疫有限公司 2023-08-22 — — CN disclosed
CN-111757882-A 1,3,4, 5-tetrahydro-2H-pyrido [4,3-b ] indole derivatives for the treatment, alleviation or prevention of disorders associated with Tau aggregates such as alzheimer's disease AC免疫有限公司 2020-10-09 — — CN disclosed
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