SCHEMBL16489027

SCHEMBL16489027

Nc1ccc(N=Nc2ccc3cc(S(=O)(=O)O)cc(S(=O)(=O)O)c3c2)c2cc(S(=O)(=O)O)cc(O)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 6/20 0.53
▸ SENP3 Q9H4L4 5/20 0.53
▸ SENP1 Q9P0U3 5/20 0.53
▸ SUMO2 P61956 4/20 0.53
▸ SUMO1 P63165 4/20 0.53
▸ SENP7 Q9BQF6 4/20 0.53
▸ CYP2C9 P11712 3/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ ENPP2 Q13822 2/20 0.48
▸ MAPK1 P28482 2/20 0.47
▸ DNASE1L3 Q13609 1/20 0.47
▸ PHLPP2 Q6ZVD8 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ PTPRC P08575 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ PTPN1 P18031 1/20 0.46
▸ PTPN6 P29350 1/20 0.46
▸ PTPN7 P35236 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
SCHEMBL24187582 0.92 SENP2 (0.53) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL24187638 0.91 CYP2C9 (0.59) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL24187581 0.91 SENP2 (0.58) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15281248 0.91 CYP1A2 (0.52) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15281246 0.89 CYP2C9 (0.55) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL20735392 0.87 HSD17B10 (0.64) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL16488653 0.86 SENP2 (0.55) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL20735276 0.86 SENP2 (0.65) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15281259 0.85 ATIC (0.60) SENP2SENP3SENP1SUMO2SUMO1
SCHEMBL15281252 0.85 HSD17B10 (0.63) SENP2SENP3SENP1SUMO2SUMO1

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-9499707-B2 Water soluble and water fast dyes for ink jet printing REX-TONE INDUSTRIES LTD (IN) 2016-11-22 — — US disclosed
US-20150050466-A1 Water Soluble and Water Fast Dyes for Ink Jet Printing ILFORD IMAGING SWITZERLAND GMBH (CH) 2015-02-19 — — US disclosed
Send feedback