SCHEMBL4356703

SCHEMBL4356703

O=C(CC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1ccc2ccccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ HPGD P15428 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ HDAC1 Q13547 5/20 0.45
▸ HDAC8 Q9BY41 3/20 0.45
▸ HDAC7 Q8WUI4 2/20 0.45
▸ HDAC3 O15379 2/20 0.45
▸ HDAC2 Q92769 2/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45
▸ HDAC11 Q96DB2 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ HDAC9 Q9UKV0 1/20 0.45
▸ HDAC5 Q9UQL6 1/20 0.45
▸ CES2 O00748 1/20 0.44
▸ CES1 P23141 1/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43

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
SCHEMBL4360557 1.00 PTPN1 (0.49) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL1095075 0.94 PTPN1 (0.51) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL4866925 0.88 PTPN1 (0.54) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL592024 0.82 PLOD2 (0.57) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL29524110 0.82 PLOD2 (0.57) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL11836186 0.82 MEN1 (0.52) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL7581750 0.82 MEN1 (0.52) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL30466754 0.82 MEN1 (0.52) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL7587858 0.82 MEN1 (0.52) PTPN1SMN1; SMN2HPGDKDM4EHDAC1
SCHEMBL14249438 0.81 PLOD2 (0.56) PTPN1SMN1; SMN2HPGDKDM4EHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618555-B2 Ink composition containing red luminous material ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2009-11-17 — — US disclosed
US-20080245267-A1 Ink composition containing red luminous material ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2008-10-09 — — US disclosed
US-6846350-B2 Red luminous ink composition ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2005-01-25 — — US disclosed
EP-1277811-B1 Red luminous ink composition ORIENT CHEMICAL IND (JP) 2004-10-06 — — EP disclosed
US-20030106460-A1 Red luminous ink composition ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-12 — — US disclosed
EP-1277811-A1 Red luminous ink composition Orient Chemical Industries, Ltd. (JP) 2003-01-22 — — EP disclosed
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