SCHEMBL29348227

SCHEMBL29348227

C=C1CN(C)c2ncccc2N1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 4/20 0.35
TP53 P04637 3/20 0.35
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.32
KMT2A Q03164 1/20 0.32
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
KCNN4 O15554 1/20 0.30

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
SCHEMBL29348228 0.82 SMN1; SMN2 (0.39) SMN1; SMN2LMNAGAATP53MAPT
SCHEMBL29348324 0.76 CYP3A4 (0.32)
SCHEMBL17244886 0.73
SCHEMBL25629019 0.71 GAA (0.41) SMN1; SMN2LMNAGAATP53MAPT
SCHEMBL17244887 0.70 HRH1 (0.36) SMN1; SMN2LMNAMAPTDPP8DPP9
SCHEMBL25509137 0.70 KCNQ2 (0.31) SMN1; SMN2DPP8DPP9
SCHEMBL24342186 0.69 GAA (0.47) SMN1; SMN2LMNAGAATP53MAPT
SCHEMBL15823778 0.68 SMN1; SMN2 (0.42) SMN1; SMN2LMNAGAATP53MAPT
SCHEMBL178982 0.68 GAA (0.45) SMN1; SMN2LMNAGAATP53MAPT
SCHEMBL25509142 0.67 HDAC6 (0.36) SMN1; SMN2LMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO disclosed