SCHEMBL91635

SCHEMBL91635

Cc1ccc(Cl)c2c1SCC2=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.40
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
BRD4 O60885 1/20 0.31
HSD17B3 P37058 1/20 0.30

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
SCHEMBL10606233 0.84 ADORA2A (0.33) CES1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL91636 0.82 CES1 (0.38) CES1ALDH1A1HPGDSMN1; SMN2HTR2A
SCHEMBL15624267 0.79 HTR2A (0.38) HTR2AHTR2CHTR2BMEN1KMT2A
SCHEMBL5414592 0.78 TDP2 (0.31)
SCHEMBL9167527 0.76 ALDH1A1 (0.33) ALDH1A1HPGDSMN1; SMN2
SCHEMBL83211 0.72 PDE7A (0.40) ALDH1A1HPGDSMN1; SMN2HTR2CHTR2B
SCHEMBL8249306 0.70 CES1 (0.40) CES1ALDH1A1HPGDSMN1; SMN2MEN1
SCHEMBL69677 0.70 ALDH1A1 (0.30) ALDH1A1HPGDSMN1; SMN2
SCHEMBL11638880 0.68 KDM4E (0.37) ALDH1A1KMT2A
SCHEMBL8346491 0.65 VHL (0.41) CES1ALDH1A1SMN1; SMN2HTR2AHTR2C

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
US-9211725-B2 Inkjet recording method and printed material FUJIFILM CORPORATION (JP) 2015-12-15 US disclosed
US-8147921-B2 Ink set for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2012-04-03 US disclosed
US-8129447-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2012-03-06 US disclosed
US-8110253-B2 Ink composition FUJIFILM CORPORATION (JP) 2012-02-07 US disclosed
US-7985785-B2 Ink composition and inkjet recording method using the same FUJIFILM CORPORATION (JP) 2011-07-26 US disclosed