SCHEMBL8124087

SCHEMBL8124087

CCCOC(=O)c1ccc(NC=C2C(=O)CC(C)(C)CC2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 13/20 0.51
▸ RAB9A P51151 6/20 0.50
▸ SMN1; SMN2 Q16637 6/20 0.50
▸ MAPT P10636 6/20 0.50
▸ NPC1 O15118 5/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ HPGD P15428 7/20 0.47
▸ TDP1 Q9NUW8 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ ESR1 P03372 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ KDR P35968 1/20 0.46
▸ MEN1 O00255 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ THRB P10828 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ MAPK1 P28482 2/20 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
SCHEMBL8121433 0.93 HPGD (0.52) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8124848 0.92 ALDH1A1 (0.48) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8121621 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8115643 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8106868 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8121136 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8105934 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8105695 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8116042 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL8114900 0.91 ALDH1A1 (0.49) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1

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-6114546-A Aminomethylene derivatives and ultraviolet absorbent comprising thereof CHEMIPRO KASEI KAISHA, LIMITED (JP) 2000-09-05 — — US disclosed
EP-0950655-A1 AMINOMETHYLENE DERIVATIVES AND ULTRAVIOLET ABSORBER COMPRISING THE SAME CHEMIPRO KASEI KAISHA, LIMITED (JP) 1999-10-20 — — EP disclosed
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