SCHEMBL8933376

SCHEMBL8933376

COc1ccc(CP(=S)(c2ccccc2)c2cccc3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ ALOX12 P18054 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ PTPN1 P18031 1/20 0.39
▸ CACNA1B Q00975 1/20 0.38
▸ APBA1 Q02410 1/20 0.38
▸ MAPT P10636 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ PHLPP2 Q6ZVD8 1/20 0.37

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
SCHEMBL8933378 1.00 RAB9A (0.43) RAB9AL3MBTL1TDP1ALDH1A1ALOX12
SCHEMBL8933334 0.82 KMT2A (0.57) RAB9AL3MBTL1TDP1ALDH1A1MEN1
SCHEMBL8933335 0.82 KMT2A (0.57) RAB9AL3MBTL1TDP1ALDH1A1MEN1
SCHEMBL8933373 0.80 RAB9A (0.49) RAB9AL3MBTL1TDP1ALDH1A1ALOX12
SCHEMBL8933374 0.80 RAB9A (0.49) RAB9AL3MBTL1TDP1ALDH1A1ALOX12
SCHEMBL8933333 0.73 MAPT (0.49) RAB9AL3MBTL1TDP1ALDH1A1MEN1
SCHEMBL7159701 0.73 MAPT (0.49) RAB9AL3MBTL1TDP1ALDH1A1MEN1
SCHEMBL27638256 0.70 LTA4H (0.57) RAB9AALDH1A1MEN1KMT2ALTA4H
SCHEMBL30770163 0.70 RAB9A (0.48) RAB9AL3MBTL1TDP1ALDH1A1LMNA
SCHEMBL5619493 0.70 RAB9A (0.48) RAB9AL3MBTL1TDP1ALDH1A1LMNA

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-1996024601-A1 COMPLEXES, PROCESSES FOR THEIR PREPARATION AND THEIR USE UNIVERSITY COLLEGE DUBLIN (IE) 1996-08-15 — — WO claimed
WO-1996024601-A1 COMPLEXES, PROCESSES FOR THEIR PREPARATION AND THEIR USE UNIVERSITY COLLEGE DUBLIN (IE) 1996-08-15 — — WO disclosed
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