SCHEMBL31057966

SCHEMBL31057966

CCOC(=O)Cc1csc(-c2ccc(O)cc2Cl)n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ KMT2A Q03164 5/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ SHMT1 P34896 3/20 0.50
▸ POLB P06746 1/20 0.49
▸ CYP2C8 P10632 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ LMNA P02545 3/20 0.48
▸ KDM4E B2RXH2 3/20 0.48
▸ CFTR P13569 1/20 0.47
▸ SHMT2 P34897 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ GAA P10253 1/20 0.47

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
SCHEMBL20241695 0.89 SHMT1 (0.62) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL14098693 0.81 MAPT (0.60) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL20241665 0.81 SHMT1 (0.65) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL31578841 0.81 MEN1 (0.50) MAPTSMN1; SMN2KMT2AMEN1CYP2C9
SCHEMBL8847666 0.81 MAPT (0.53) MAPTSMN1; SMN2KMT2AMEN1CYP2C9
SCHEMBL30163400 0.80 MAPT (0.56) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL20241545 0.80 MAPT (0.56) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL20241893 0.80 KMT2A (0.51) MAPTSMN1; SMN2KMT2AMEN1POLB
SCHEMBL20241846 0.79 MAPT (0.55) MAPTSMN1; SMN2KMT2AMEN1SHMT1
SCHEMBL20241746 0.78 MAPT (0.54) MAPTSMN1; SMN2KMT2AMEN1SHMT1

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-2024173718-A2 HETEROBIFUNCTIONAL BINDERS OF KLHDC2 ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2024-08-22 — — WO disclosed
Send feedback