SCHEMBL8945215

SCHEMBL8945215

Oc1nc(S)nc2cccnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.42
TSHR P16473 2/20 0.42
PSMD14 O00487 2/20 0.42
COPS5 Q92905 2/20 0.42
CHRM1 P11229 1/20 0.42
COMT P21964 1/20 0.42
ADRA1A P35348 1/20 0.42
METAP2 P50579 1/20 0.42
METAP1 P53582 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
KDM4E B2RXH2 5/20 0.40
HSP90AA1 P07900 3/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL3705881 0.80 MMP2 (0.45) MMP2TSHRPSMD14COPS5CHRM1
SCHEMBL30308911 0.80 MMP2 (0.45) MMP2TSHRPSMD14COPS5CHRM1
SCHEMBL11860802 0.77 METAP2 (0.42) MMP2TSHRCHRM1COMTADRA1A
SCHEMBL31353938 0.77 PRMT5 (0.47) MMP2TSHRPSMD14COPS5CHRM1
SCHEMBL8207691 0.77 PRMT5 (0.47) MMP2TSHRPSMD14COPS5KDM4E
SCHEMBL31354076 0.73 LMNA (0.41) MMP2TSHRPSMD14COPS5CHRM1
SCHEMBL31354383 0.73 TOP1 (0.43) MMP2TSHRCHRM1COMTADRA1A
SCHEMBL8945454 0.73 PRMT5 (0.40) MMP2TSHRCHRM1COMTADRA1A
SCHEMBL28802010 0.69 KDM4E (0.41) TSHRCHRM1ADRA1AKDM4ELMNA
SCHEMBL3237268 0.69 EGFR (0.45) MMP2TSHRCHRM1COMTADRA1A

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
US-5494887-A Ring annulated 5-alkoxy-n-aryl[1,2,4]triazolo[1,5-C]-pyrimidine-2-sulfonamide herbicides DOWELANCO (US) 1996-02-27 US disclosed