SCHEMBL9725601

SCHEMBL9725601

FC(F)(F)c1ccc(NS)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.43
GRM4 Q14833 1/20 0.43
RAPGEF4 Q8WZA2 1/20 0.39
PDK1 Q15118 1/20 0.39
CNR1 P21554 1/20 0.39
RAPGEF3 O95398 3/20 0.38
TRPV1 Q8NER1 2/20 0.38
FLT1 P17948 2/20 0.37
KCNJ5 P48544 1/20 0.37
KCNJ3 P48549 1/20 0.37
LMNA P02545 1/20 0.36
CNR2 P34972 1/20 0.36
FAAH O00519 1/20 0.35
BRAF P15056 1/20 0.35
HDAC1 Q13547 1/20 0.35

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
SCHEMBL11265425 0.86 TSHR (0.36) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL11414045 0.80 KDR (0.47) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL11525237 0.80 KDR (0.43) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL19089350 0.80 AR (0.45) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL10389130 0.78 RAPGEF3 (0.42) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL20656067 0.77 RAPGEF3 (0.41) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL11595628 0.77 KDR (0.49) KDRGRM4PDK1TRPV1FLT1
SCHEMBL20655719 0.76 AR (0.49) KDRGRM4RAPGEF4PDK1CNR1
SCHEMBL4556067 0.76 KDR (0.75) KDRPDK1TRPV1LMNABRAF
SCHEMBL25698906 0.76 KDR (0.40) KDRGRM4RAPGEF4PDK1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5095032-A PARASITICIDAL NEW SUBSTITUTED THIENOPYRANONES BAYER AKTIENGESELLSCHAFT (DE) 1992-03-10 US disclosed
US-4804655-A Pesticidal cyclic malonylphosphonic diamides BAYER AKTIENGESELLSCHAFT (DE) 1989-02-14 US disclosed
US-4771048-A VETERINARY MEDICINE BAYER AKTIENGESELLSCHAFT (DE) 1988-09-13 US disclosed
US-4766144-A 3-carbamoyl-4-hydroxy-coumarins for combating parasitic heiminths BAYER AKTIENGESELLSCHAFT (DE) 1988-08-23 US disclosed
US-4459304-A MITICIDES, NEMATOCIDES, FUNGICIDES, BACTERICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1984-07-10 US disclosed
US-4318919-A Combating bacteria with tetrachlorophthalamic acids BAYER AKTIENGESELLSCHAFT (DE) 1982-03-09 US disclosed
US-4293566-A FUNGICIDES, BACTERICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-10-06 US disclosed
US-4183949-A Pesticidally active 1-arylamino-2,4-dinitronaphthalenes BAYER AKTIENGESELLSCHAFT (DE) 1980-01-15 US disclosed