SCHEMBL31616465

SCHEMBL31616465

COc1ccc(NC(=O)N[C@@H](C)c2cccc3ccccc23)cc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ IDH1 O75874 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ TRPV1 Q8NER1 2/20 0.52
▸ BMP1 P13497 2/20 0.52
▸ NPC1 O15118 2/20 0.51
▸ RAB9A P51151 2/20 0.51
▸ PKM P14618 1/20 0.51

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
SCHEMBL31616458 1.00 KMT2A (0.53) KMT2AMEN1ALDH1A1LMNAIDH1
SCHEMBL31616452 1.00 KMT2A (0.53) KMT2AMEN1ALDH1A1LMNAIDH1
SCHEMBL31616447 0.86 LTC4S (0.57) KMT2AMEN1ALDH1A1LMNARAB9A
SCHEMBL31616418 0.86 LTC4S (0.57) KMT2AMEN1ALDH1A1LMNARAB9A
SCHEMBL31616462 0.85 IDH1 (0.69) LMNAIDH1TRPV1
SCHEMBL31616396 0.85 IDH1 (0.69) LMNAIDH1TRPV1
SCHEMBL31616459 0.85 IDH1 (0.69) LMNAIDH1TRPV1
SCHEMBL31616384 0.85 IDH1 (0.54) KMT2AMEN1LMNAIDH1TRPV1
SCHEMBL31616425 0.85 IDH1 (0.54) KMT2AMEN1LMNAIDH1TRPV1
SCHEMBL31616412 0.85 IDH1 (0.54) KMT2AMEN1LMNAIDH1TRPV1

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
WO-2025122121-A2 COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND THE METHOD OF OBTAINING THESE COMPOUNDS HACETTEPE UNIVERSITESI REKTORLUK (TR) 2025-06-12 — — WO claimed
WO-2025122121-A2 COMPOUNDS FOR THE TREATMENT OF ALZHEIMER'S DISEASE AND THE METHOD OF OBTAINING THESE COMPOUNDS HACETTEPE UNIVERSITESI REKTORLUK (TR) 2025-06-12 — — WO disclosed
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