SCHEMBL19750415

SCHEMBL19750415

CC(C)C(=O)c1cccc(C(=O)Nc2ccc(-c3ccc(N)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ MAPT P10636 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ RAB9A P51151 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ OPRD1 P41143 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ GNG2 P59768 1/20 0.41
▸ GNB1 P62873 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ ACE2 Q9BYF1 1/20 0.41
▸ ALDH1A1 P00352 3/20 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
SCHEMBL19491776 0.90 CASP6 (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL17804058 0.83 NPC1 (0.60) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL15698719 0.81 NAT1 (0.43) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL25664271 0.81 LMNA (0.52) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL16208330 0.79 MAPT (0.55) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL22304464 0.78 PTGS1 (0.51) MEN1KMT2AMAPTRAB9APOLB
SCHEMBL25664203 0.77 CASP6 (0.46) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL13283610 0.77 KMT2A (0.50) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL17491046 0.77 ALDH1A1 (0.48) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL4905086 0.75 PTGS1 (0.54) MEN1KMT2AHSD17B10THRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9852846-B2 Self-healing capacitor and methods of production thereof CAPACITOR SCIENCES INCORPORATED (US) 2017-12-26 — — US disclosed
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