SCHEMBL10472007

SCHEMBL10472007

COC(=O)C1Oc2ccccc2Cc2cccc(SC)c2O1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
MAPT P10636 2/20 0.33
GAA P10253 1/20 0.33
NISCH Q9Y2I1 1/20 0.33
KMT2A Q03164 4/20 0.32
MEN1 O00255 3/20 0.32
TSHR P16473 3/20 0.32

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
SCHEMBL10470737 0.86 POLB (0.41) HSD17B10LMNAPOLBHPGDALDH1A1
SCHEMBL9752005 0.85 MAOA (0.42) HSD17B10POLBHPGDALDH1A1RAB9A
SCHEMBL10470798 0.85 CA12 (0.34) HSD17B10LMNAHPGDALDH1A1NPSR1
SCHEMBL10472315 0.85 HDAC4 (0.35) HPGDALDH1A1NPSR1GABRA1GABRB2
SCHEMBL9752013 0.85 KMT2A (0.38) ALDH1A1GABRA1GABRB2NISCHKMT2A
SCHEMBL10471566 0.84 CTNNB1 (0.39) HSD17B10HPGDALDH1A1SMN1; SMN2RAB9A
SCHEMBL10470238 0.84 TDP1 (0.38) ALDH1A1GABRA1GABRB2MAPTGAA
SCHEMBL10471599 0.84 L3MBTL1 (0.36) HSD17B10HPGDALDH1A1GABRA1GABRB2
SCHEMBL9752006 0.82 ATM (0.33) HSD17B10HPGDALDH1A1NPSR1GABRA1
SCHEMBL10471929 0.81 TDP1 (0.36) LMNASMN1; SMN2NPSR1GABRA1GABRB2

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-4979978-A Herbicidal 12H-dibenzo[d,g][1,3]dioxocin-6-carboxylic acids THE DOW CHEMICAL COMPANY (US) 1990-12-25 US disclosed