SCHEMBL7819583

SCHEMBL7819583

CN(c1ccccc1)S(=O)(=O)c1ccc2c(c1)C1OC1C(C)(C)O2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CA12 O43570 1/20 0.45
CA9 Q16790 1/20 0.45
POLB P06746 1/20 0.43
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.39
KCNA5 P22460 1/20 0.39
NR1H3 Q13133 1/20 0.38
NR1I2 O75469 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
PGR P06401 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
SCHEMBL7811977 0.90 ATM (0.41) ATML3MBTL1CA12CA9POLB
SCHEMBL7825809 0.90 FFAR1 (0.44) ATML3MBTL1NPC1RAB9AMAPT
SCHEMBL7821131 0.88 PGR (0.48) ATML3MBTL1POLBLMNAHTT
SCHEMBL7821557 0.87 SERPINE1 (0.40) ATML3MBTL1POLBNPC1RAB9A
SCHEMBL7820690 0.87 ATM (0.39) ATML3MBTL1POLBKCNA5MEN1
SCHEMBL9195467 0.86 TSHR (0.40) POLBNPC1RAB9ATSHRMEN1
SCHEMBL7821015 0.86 PGR (0.44) ATML3MBTL1POLBLMNASMN1; SMN2
SCHEMBL7824308 0.85 KCNA5 (0.39) ATML3MBTL1POLBKCNA5MEN1
SCHEMBL7822282 0.85 ESR1 (0.48) POLBLMNASMN1; SMN2RAB9ATSHR
SCHEMBL3442031 0.81 ABCC9 (0.48) POLBSMN1; SMN2KCNA5MAPTKCNE1

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-0828733-B1 BENZOPYRANS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM NOVARTIS AG (CH) 2001-09-05 EP disclosed