SCHEMBL12894580

SCHEMBL12894580

O=C(O)c1cc(/C=C/c2ccc3ccccc3n2)ccc1O

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 12/20 0.68
▸ CYSLTR1 Q9Y271 12/20 0.68
▸ PIM1 P11309 2/20 0.65
▸ PTPN1 P18031 2/20 0.62
▸ HNF4A P41235 1/20 0.62
▸ KDM4E B2RXH2 3/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ NPC1 O15118 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ ALDH1A1 P00352 2/20 0.59
▸ MAPT P10636 2/20 0.59
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ PTPN2 P17706 1/20 0.59
▸ PTPN6 P29350 1/20 0.59
▸ PKM P14618 1/20 0.57

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
SCHEMBL12866125 0.83 RAB9A (0.69) CYSLTR2CYSLTR1PIM1KDM4EMEN1
SCHEMBL3860498 0.83 RAB9A (0.69) CYSLTR2CYSLTR1PIM1KDM4EMEN1
SCHEMBL6175619 0.81 CYSLTR2 (1.00) CYSLTR2CYSLTR1KDM4EMEN1KMT2A
SCHEMBL6175612 0.81 CYSLTR2 (1.00) CYSLTR2CYSLTR1KDM4EMEN1KMT2A
SCHEMBL29230090 0.80 KDM4E (0.61) CYSLTR2CYSLTR1KDM4EMEN1KMT2A
SCHEMBL29230091 0.80 KDM4E (0.61) CYSLTR2CYSLTR1KDM4EMEN1KMT2A
SCHEMBL2399852 0.79 KDM4E (0.71) CYSLTR2CYSLTR1PIM1KDM4EMEN1
SCHEMBL2399856 0.79 KDM4E (0.71) CYSLTR2CYSLTR1PIM1KDM4EMEN1
SCHEMBL29696944 0.79 PIM1 (1.00) PIM1PTPN1PTPN2PTPN6
SCHEMBL21385358 0.78 PTPN1 (1.00) PIM1PTPN1HNF4APTPN2PTPN6

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-20110031446-A1 Dye-Sensitized Photoelectric Conversion Device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 — — US disclosed
US-7851701-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-12-14 — — US disclosed
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