SCHEMBL11575253

SCHEMBL11575253

O=C(C(=O)c1ccc2c(c1)oc1c(C(=O)C(=O)c3ccccc3)cccc12)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 4/20 0.45
▸ CES2 O00748 7/20 0.43
▸ CES1 P23141 6/20 0.43
▸ HTR2B P41595 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ DYRK1A Q13627 1/20 0.39
▸ PTPRF P10586 1/20 0.38
▸ PTPN2 P17706 1/20 0.38
▸ PTPN1 P18031 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ HCRTR1 O43613 1/20 0.36
▸ CYSLTR1 Q9Y271 1/20 0.36
▸ TNKS O95271 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
SCHEMBL15041013 0.76 TTR (0.65) TTRHTR2BTNKS
SCHEMBL22645256 0.74 MAPT (0.51) HDAC1HDAC8HDAC6PTPN1ALOX5
SCHEMBL20793652 0.73 GPR35 (0.51) TTRDYRK1A
SCHEMBL15071004 0.72 TTR (0.59) TTRCES2CES1HTR2BTNKS
SCHEMBL783749 0.72 NR4A1 (0.50) PTPRFPTPN2PTPN1ALOX5CYSLTR1
SCHEMBL7056984 0.71 PRMT1 (0.44) TTRHTR2B
SCHEMBL9450964 0.71 MEN1 (0.47) TTRPTPRFPTPN2PTPN1CYSLTR1
SCHEMBL26317302 0.70 NPC1 (0.59) TTRHTR2BDYRK1A
SCHEMBL12180808 0.70 CES2 (0.58) TTRCES2CES1TNKS
SCHEMBL11554090 0.69 PTPN1 (0.60) TTRPTPRFPTPN2PTPN1

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-4076634-A Composition for antifriction material KORSHAK VASILY VLADIMIROVICH 1978-02-28 — — US disclosed
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