SCHEMBL9760377

SCHEMBL9760377

CCOC(=O)c1c(S(=O)(=O)Nc2c(F)cccc2F)nn2c(C)cc(C)nc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 3/20 0.53
HSD17B10 Q99714 3/20 0.53
TP53 P04637 2/20 0.53
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
GAA P10253 3/20 0.44
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
HTR6 P50406 1/20 0.40
KMT2A Q03164 1/20 0.38

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
SCHEMBL9792974 0.88 KDM4E (0.53) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL9761046 0.83 ALDH1A1 (0.51) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL10774291 0.81 ALDH1A1 (0.47) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL9760348 0.80 KDM4E (0.53) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL9761030 0.79 HTR6 (0.46) KDM4EHSD17B10TSHRHTR6
SCHEMBL10774163 0.78 KDM4E (0.44) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL9760954 0.78 KDM4E (0.46) KDM4EALDH1A1HPGDLMNAHTR6
SCHEMBL9830824 0.76 ALDH1A1 (0.54) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL10774016 0.75 HTR6 (0.41) KDM4EALDH1A1HSD17B10TP53HPGD
SCHEMBL10775013 0.73 MAPT (0.46) KDM4EALDH1A1HSD17B10TP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4992091-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-02-12 US claimed
US-5021591-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-06-04 US disclosed
US-4997940-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-03-05 US disclosed
US-4992091-A Herbicides THE DOW CHEMICAL COMPANY (US) 1991-02-12 US disclosed