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SCHEMBL26083602

SCHEMBL26083602

O=C1C2C(C(=O)N1c1cc(Cl)c(O)c(Cl)c1)[C@@H]1C=CC2[C@H]2CC12

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.50
▸ ATM Q13315 1/20 0.50
▸ TRIP13 Q15645 1/20 0.46
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ MAPT P10636 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MCL1 Q07820 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
SCHEMBL26109334 1.00 ALDH1A1 (0.50) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL26109454 0.84 ALDH1A1 (0.56) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL3187253 0.84 ATM (0.58) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL3187244 0.84 ATM (0.58) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL3186419 0.83 ALDH1A1 (0.62) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL3186430 0.83 ALDH1A1 (0.62) ALDH1A1ATMTRIP13MEN1KMT2A
SCHEMBL3196397 0.81 USP2 (0.51) ALDH1A1MAPT
SCHEMBL3196409 0.81 USP2 (0.51) ALDH1A1MAPT
SCHEMBL3198129 0.78 POLB (0.54) ALDH1A1ATMMEN1KMT2A
SCHEMBL3198137 0.78 POLB (0.54) ALDH1A1ATMMEN1KMT2A

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-2023192782-A2 SMALL MOLECULE INHIBITORS OF LANOSTEROL SYNTHASE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-10-05 — — WO disclosed