SCHEMBL6607276

SCHEMBL6607276

CC[C@@H](CS(=O)(=O)Cc1cnc2ccccc2c1)NO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.42
MMP9 P14780 2/20 0.40
MMP2 P08253 2/20 0.40
MMP8 P22894 1/20 0.40
RAB9A P51151 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KMT2A Q03164 2/20 0.38
TRPV1 Q8NER1 2/20 0.38
MMP1 P03956 1/20 0.38
FCER2 P06734 1/20 0.38
MMP3 P08254 1/20 0.38
PDE10A Q9Y233 1/20 0.38
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MMP13 P45452 1/20 0.37
ACP1 P24666 1/20 0.37
HDAC6 Q9UBN7 2/20 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
SCHEMBL6607278 1.00 CYP1A2 (0.42) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6403781 0.91 CYP1A2 (0.36) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6611578 0.91 CYP1A2 (0.41) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6611575 0.91 CYP1A2 (0.41) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6401254 0.89 CYP1A2 (0.35) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6608596 0.88 KMT2A (0.41) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6608597 0.88 KMT2A (0.41) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6608483 0.88 MMP2 (0.45) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6608479 0.88 MMP2 (0.45) CYP1A2MMP9MMP2MMP8RAB9A
SCHEMBL6604910 0.85 HPGD (0.46) CYP1A2MMP9MMP2MMP8RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289980-B1 BICYCLYL OR HETEROBICYCLYLMETHANESULFONYLAMINO-SUBSTITUTED N-HYDROXYFORMAMIDES SMITHKLINE BEECHAM PLC (GB) 2004-11-17 EP disclosed