SCHEMBL13239090

SCHEMBL13239090

Cc1nc(-c2ccc(C(=O)O)cc2)c(C)s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 3/20 0.68
RARB P10826 3/20 0.68
RARG P13631 3/20 0.68
ALDH1A1 P00352 5/20 0.54
HPGD P15428 3/20 0.54
GAA P10253 4/20 0.51
KDM4E B2RXH2 4/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MAPK1 P28482 1/20 0.48
PTGDR2 Q9Y5Y4 1/20 0.47
NTRK1 P04629 1/20 0.46
MAPT P10636 1/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL13494131 0.85 RARA (0.54) RARARARBRARGALDH1A1HPGD
SCHEMBL2093741 0.77 ALDH1A1 (0.59) RARARARBRARGALDH1A1HPGD
SCHEMBL7951904 0.77 ALDH1A1 (0.65) RARARARBRARGALDH1A1HPGD
SCHEMBL792106 0.77 PTGDR2 (0.52) RARARARBRARGALDH1A1GAA
SCHEMBL1479738 0.77 RARA (0.57) RARARARBRARGALDH1A1HPGD
SCHEMBL1479736 0.77 RARA (0.57) RARARARBRARGALDH1A1HPGD
SCHEMBL1474252 0.76 RARA (0.56) RARARARBRARGALDH1A1HPGD
Hydrochloric Acid SCHEMBL5592171 0.76 RARA (0.56) RARARARBRARGALDH1A1HPGD
SCHEMBL15423321 0.76 NFKB1 (0.61) ALDH1A1KDM4ERAB9APOLBHTT
SCHEMBL1480142 0.76 RARA (0.56) RARARARBRARGALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8834619-B2 Ink composition, ink for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2014-09-16 US disclosed
US-20140013997-A1 INK COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-01-16 US disclosed
US-7758683-B2 Ink composition, ink set and recording method FUJIFILM CORPORATION (JP) 2010-07-20 US disclosed
US-7758683-B2 Ink composition, ink set and recording method FUJIFILM CORPORATION (JP) 2010-07-20 US disclosed
US-7704311-B2 Ink composition, manufacturing method of ink, ink set, and recording method FUJIFILM CORPORATION (JP) 2010-04-27 US disclosed
US-7704311-B2 Ink composition, manufacturing method of ink, ink set, and recording method FUJIFILM CORPORATION (JP) 2010-04-27 US disclosed
US-20070109376-A1 Ink composition, ink set and recording method FUJIFILM CORPORATION 2007-05-17 US disclosed
US-20070109376-A1 Ink composition, ink set and recording method FUJIFILM CORPORATION 2007-05-17 US disclosed
WO-2007046553-A1 INK COMPOSITION, MANUFACTURING METHOD OF INK, INK SET, AND RECORDING METHOD FUJIFILM CORPORATION (JP) 2007-04-26 WO disclosed