SCHEMBL8090664

SCHEMBL8090664

CCOC(=O)c1ccc2c(c1)C(n1ccccc1=O)=C(C)C(C)(C)O2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALDH1A1 P00352 5/20 0.46
RECQL P46063 1/20 0.46
USP2 O75604 1/20 0.43
ALOX15 P16050 1/20 0.43
GLA P06280 2/20 0.43
PABPC1 P11940 2/20 0.39
APOBEC3A P31941 2/20 0.39
EIF4H Q15056 2/20 0.39
APOBEC3G Q9HC16 2/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAT2A P31153 1/20 0.37
MAPK1 P28482 1/20 0.37
LMNA P02545 2/20 0.37
CTDSP1 Q9GZU7 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL8084217 0.90 ALOX5 (0.40) MAPTALDH1A1RECQLMEN1KMT2A
SCHEMBL8090525 0.87 ALDH1A1 (0.46) MAPTALDH1A1RECQLUSP2ALOX15
SCHEMBL8088434 0.86 S100A4 (0.37) MAPTALDH1A1MAPK1LMNASMN1; SMN2
SCHEMBL8077107 0.85 F10 (0.39) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL8084622 0.82 F10 (0.33) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL7277024 0.82 ALDH1A1 (0.42) MAPTALDH1A1RECQLUSP2ALOX15
SCHEMBL9379871 0.81 MAPT (0.41) MAPTALDH1A1RECQLUSP2ALOX15
SCHEMBL10521128 0.80 KDM4E (0.36) ALDH1A1HTTKDM4E
SCHEMBL9734818 0.79 ALOX5 (0.36) MAPTALDH1A1GLAMEN1KMT2A
SCHEMBL9738703 0.79 CNR2 (0.38) MAPTALDH1A1RECQLMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6153627-A Chroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-11-28 US disclosed
US-6040308-A Chroman derivatives MERCK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2000-03-21 US disclosed
US-5387587-A Chroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-07 US disclosed
US-5013853-A Chroman derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-05-07 US disclosed
EP-0340718-A1 Chroman derivatives MERCK PATENT GmbH (DE) 1989-11-08 EP disclosed