SCHEMBL9943359

SCHEMBL9943359

NN(c1ccc(Cl)cc1)S(=O)(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.49
CNR1 P21554 2/20 0.48
CNR2 P34972 2/20 0.48
PKM P14618 1/20 0.47
TDP1 Q9NUW8 1/20 0.44
NR3C1 P04150 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
KMT2A Q03164 2/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA3 P07451 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA13 Q8N1Q1 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA5B Q9Y2D0 2/20 0.43

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
SCHEMBL22257152 0.86 APOBEC3G (0.52) PKMTDP1APOBEC3GKMT2ACA12
SCHEMBL6432835 0.86 APOBEC3G (0.52) PKMTDP1APOBEC3GKMT2ACA12
SCHEMBL14940242 0.83 CYP3A4 (0.47) PKMTDP1NR3C1APOBEC3GKMT2A
SCHEMBL28433742 0.82 KDM4E (0.60) CNR1CNR2CA12CA1CA2
SCHEMBL27336572 0.81 CA12 (0.56) CNR1CNR2NR3C1KMT2ACA12
SCHEMBL27492178 0.81 PGR (0.46) PGRAPOBEC3GKDM4EALDH1A1CYP3A4
SCHEMBL10186889 0.78 PGR (0.74) PGRCA12CA9KDM4EMAPK1
SCHEMBL9703223 0.76 ALDH1A1 (0.58) PGRPKMTDP1KMT2ACA12
SCHEMBL28226725 0.76 MEN1 (0.54) NR3C1KMT2ACA12CA1CA2
SCHEMBL7545347 0.76 PKM (0.48) PKMTDP1NR3C1KMT2ACA12

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
CN-108276305-A A method of mild prepares Sudan red 1 analogue 江西理工大学 2018-07-13 CN disclosed
EP-1960347-B1 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS STERIX LTD (GB) 2012-06-20 EP disclosed