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SCHEMBL8826230

SCHEMBL8826230

O=C(O)[C@H]1[C@H](C(=O)N(Cc2ccccc2)Cc2ccc(Cl)cc2)[C@H](C(=O)O)[C@H]1C(=O)N(Cc1ccccc1)Cc1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AGER Q15109 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TAS2R14 Q9NYV8 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ CXCR3 P49682 1/20 0.45
▸ C5AR1 P21730 1/20 0.43

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
SCHEMBL8497090 1.00 AGER (0.47) AGERMEN1KMT2ATAS2R14POLB
SCHEMBL8497094 1.00 AGER (0.47) AGERMEN1KMT2ATAS2R14POLB
SCHEMBL8826234 1.00 AGER (0.47) AGERMEN1KMT2ATAS2R14POLB
SCHEMBL8496214 0.90 MEN1 (0.54) MEN1KMT2A
SCHEMBL8826139 0.90 MEN1 (0.54) MEN1KMT2A
SCHEMBL8826133 0.90 MEN1 (0.54) MEN1KMT2A
SCHEMBL8496217 0.90 MEN1 (0.54) MEN1KMT2A
SCHEMBL8496219 0.90 MEN1 (0.54) MEN1KMT2A
SCHEMBL8696049 0.83 AGER (0.44) AGERMEN1KMT2ATAS2R14POLB
SCHEMBL8826152 0.82 NR3C1 (0.51) —

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
US-5631401-A Inhibitors of protein farnesyltransferase and squalene synthase ABBOTT LABORATORIES (US) 1997-05-20 — — US disclosed
WO-1995021815-A1 CYCLOBUTANE DERIVATIVES AND THEIR USE AS INHIBITORS OF PROTEIN FARNESYLTRANSFERASE AND SQUALENE SYNTHASE ABBOTT LABORATORIES (US) 1995-08-17 — — WO disclosed
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