SCHEMBL10050686

SCHEMBL10050686

C=C(C)C(=O)OCCSc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.55
TDP1 Q9NUW8 3/20 0.46
HTT P42858 2/20 0.46
POLB P06746 1/20 0.46
APEX1 P27695 1/20 0.46
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
ALDH1A1 P00352 7/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2C9 P11712 2/20 0.41
HPGD P15428 2/20 0.41
CYP2C19 P33261 2/20 0.41
MAPT P10636 3/20 0.41
RECQL P46063 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL2865794 0.94 TDP1 (0.47) ELANETDP1HTTPOLBAPEX1
SCHEMBL21889383 0.90 TDP1 (0.44) ELANETDP1HTTPOLBAPEX1
SCHEMBL2392778 0.88 MTNR1A (0.50) ELANETDP1HTTPOLBAPEX1
SCHEMBL4448972 0.86 HSD17B10 (0.40) ELANETDP1HTTPOLBAPEX1
SCHEMBL11299567 0.85 ELANE (0.51) ELANETDP1HTTNPC1RAB9A
SCHEMBL5424465 0.84 ELANE (0.41) ELANETDP1HTTPOLBAPEX1
SCHEMBL31552431 0.84 ELANE (0.52) ELANETDP1HTTPOLBAPEX1
SCHEMBL31552430 0.84 ELANE (0.52) ELANETDP1HTTPOLBAPEX1
SCHEMBL21889384 0.82 POLB (0.52) ELANETDP1HTTPOLBAPEX1
SCHEMBL11301248 0.82 ALDH1A1 (0.47) ELANETDP1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2228417-B1 Ink composition and inkjet recording method FUJIFILM CORP (JP) 2015-01-07 EP disclosed
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed