SCHEMBL17936628

SCHEMBL17936628

O=S(=O)(Cl)c1ccccc1-c1c2cc/c(=N/c3ccccc3)cc-2oc2cc(Nc3ccccc3)ccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DNASE1L3 Q13609 1/20 0.33
PRMT1 Q99873 1/20 0.33
ABCB1 P08183 1/20 0.33
ATM Q13315 3/20 0.32
USP2 O75604 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
PLEC Q15149 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CFTR P13569 1/20 0.32
PAX8 Q06710 1/20 0.32
GOPC Q9HD26 1/20 0.32
TNNI3 P19429 1/20 0.32
TNNT2 P45379 1/20 0.32

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
SCHEMBL17936618 0.91 TNNI3 (0.40) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL17552993 0.91 CA9 (0.37) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL24226783 0.91 TNNI3 (0.40) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL14405513 0.83 PHLPP2 (0.42) ALDH1A1LMNAL3MBTL1PRMT1ABCB1
SCHEMBL15806640 0.81 ABCB1 (0.33) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL15836270 0.81 ABCB1 (0.33) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL17552991 0.81 ABCB1 (0.44) ALDH1A1LMNAL3MBTL1DNASE1L3PRMT1
SCHEMBL22849929 0.81 ALDH1A1 (0.32) ALDH1A1LMNAL3MBTL1ABCB1ATM
SCHEMBL21450699 0.81 USP2 (0.35) ALDH1A1LMNAL3MBTL1ABCB1ATM
SCHEMBL16124829 0.81 PHLPP2 (0.43) ALDH1A1L3MBTL1PRMT1ABCB1ATM

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-9670364-B2 Compound having xanthene skeleton, colorant composition, ink for inkjet recording, inkjet recording method, inkjet printer cartridge, and inkjet recording material FUJIFILM CORPORATION (JP) 2017-06-06 US disclosed
US-20160208102-A1 COMPOUND HAVING XANTHENE SKELETON, COLORANT COMPOSITION, INK FOR INKJET RECORDING, INKJET RECORDING METHOD, INKJET PRINTER CARTRIDGE, AND INKJET RECORDING MATERIAL FUJIFILM CORPORATION (JP) 2016-07-21 US disclosed