SCHEMBL8107328

SCHEMBL8107328

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.39
▸ KMT2A Q03164 3/20 0.37
▸ MAPT P10636 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KDM4E B2RXH2 4/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ GAA P10253 3/20 0.34
▸ CYP11B2 P19099 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ TSHR P16473 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ CTNNB1 P35222 1/20 0.33
▸ OPRM1 P35372 1/20 0.33

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
SCHEMBL8121966 0.88 ALDH1A1 (0.40) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8120181 0.88 ALDH1A1 (0.42) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8114885 0.82 HSD17B10 (0.53) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8116420 0.82 ALDH1A1 (0.55) ALDH1A1RAB9ASMN1; SMN2HSD17B10MAPK1
SCHEMBL12830162 0.79 RAB9A (0.43) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8122692 0.79 ALDH1A1 (0.40) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8124087 0.79 ALDH1A1 (0.51) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8109297 0.78 ALDH1A1 (0.41) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8122754 0.78 ALDH1A1 (0.61) ALDH1A1KMT2AMAPTRAB9ANPC1
SCHEMBL8117394 0.78 ALDH1A1 (0.36) ALDH1A1KMT2AMAPTRAB9ANPC1

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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