SCHEMBL11243950

SCHEMBL11243950

Cc1c(C#N)ccc(OP(O)(O)=S)c1C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.38
ALDH1A1 P00352 3/20 0.35
IMPDH2 P12268 1/20 0.35
IMPDH1 P20839 1/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
MAOB P27338 2/20 0.32
MAOA P21397 1/20 0.31
TSHR P16473 1/20 0.31
UPP1 Q16831 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL18550506 0.76 ALDH1A1 (0.39) ARALDH1A1IMPDH2IMPDH1KDM4E
SCHEMBL6779862 0.76 MAPT (0.36)
SCHEMBL3000243 0.74 ALDH1A1 (0.55) ARALDH1A1IMPDH2IMPDH1KDM4E
SCHEMBL27540471 0.73 GAA (0.43) ALDH1A1KDM4EMAOATSHRHPGD
SCHEMBL1585098 0.72 AR (0.52) ARALDH1A1IMPDH2IMPDH1KDM4E
SCHEMBL11243948 0.70 AR (0.31) ARALDH1A1IMPDH2IMPDH1KDM4E
SCHEMBL10540003 0.67 ALDH1A1 (0.52) ARALDH1A1IMPDH2IMPDH1KDM4E
SCHEMBL8469167 0.67 MAPT (0.56) ALDH1A1KDM4E
SCHEMBL8673406 0.66
SCHEMBL14138740 0.65 AR (0.43) ARALDH1A1IMPDH2IMPDH1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327109-A INSECTICIDES SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1982-04-27 US disclosed
US-4229469-A Insecticidal alkadienylcyclopropanecarboxylates SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1980-10-21 US disclosed
US-4118505-A INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1978-10-03 US disclosed
US-3998868-A INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-12-21 US disclosed
US-3954814-A INSECTICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-05-04 US disclosed