SCHEMBL10600156

SCHEMBL10600156

CC(N)Nc1ccc(N)cc1S(=O)(=O)Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
APEX1 P27695 1/20 0.41
APOBEC3A P31941 1/20 0.41
RECQL P46063 1/20 0.41
CASP6 P55212 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.38
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
C1S P09871 1/20 0.37

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
SCHEMBL14988897 0.82 CA1 (0.43) CCR2ALDH1A1MAPTKDM4ENSD2
SCHEMBL9809130 0.78 APEX1 (0.41) CCR2ALDH1A1MAPTKDM4ENSD2
SCHEMBL9809141 0.77 CCR2 (0.42) CCR2ALDH1A1MAPTKDM4ENSD2
SCHEMBL9711529 0.76 RAPGEF4 (0.58) ALDH1A1MAPTKDM4ENSD2POLB
SCHEMBL3653053 0.75 TSHR (0.47) CCR2ALDH1A1MAPTKDM4ENSD2
Monoethanolamine SCHEMBL14989152 0.75 ALDH1A1 (0.40) CCR2ALDH1A1MAPTKDM4ENSD2
SCHEMBL9878782 0.73 RAPGEF4 (0.41) ALDH1A1MAPTKDM4ENSD2POLB
SCHEMBL14988898 0.73 TOP2B (0.46) CCR2ALDH1A1MAPTKDM4ENSD2
SCHEMBL10633547 0.71 KDM4E (0.41) ALDH1A1MAPTKDM4ENSD2POLB
Hydrochloric Acid SCHEMBL10632560 0.70 KDM4E (0.40) ALDH1A1MAPTKDM4ENSD2POLB

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
EP-0199036-B1 TRIPHENEDIOXAZINE DYES BAYER AG (DE) 1989-01-25 EP disclosed
US-4665179-A FIBER-REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DE) 1987-05-12 US disclosed