SCHEMBL9712795

SCHEMBL9712795

COc1cccc(OC)c1C(=O)Nc1nnc(C(C)(C)C(Cl)Cl)s1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.62
ALDH1A1 P00352 6/20 0.62
KDM4E B2RXH2 5/20 0.59
HSD17B10 Q99714 2/20 0.59
MAPT P10636 2/20 0.56
PPARG P37231 1/20 0.56
NCOA2 Q15596 1/20 0.56
NCOA1 Q15788 1/20 0.56
ABL1 P00519 1/20 0.55
RIN1 Q13671 1/20 0.55
NPC1 O15118 6/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
RAB9A P51151 6/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 1/20 0.44

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
SCHEMBL9712990 0.89 ALDH1A1 (0.67) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9713727 0.87 ALDH1A1 (0.64) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9713321 0.87 TP53 (0.70) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9712867 0.85 ALDH1A1 (0.61) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9713274 0.84 TP53 (0.67) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9713061 0.84 TP53 (0.62) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL10450136 0.84 TP53 (0.62) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9713494 0.82 ALDH1A1 (0.67) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9712941 0.82 ALDH1A1 (0.67) TP53ALDH1A1KDM4EHSD17B10MAPT
SCHEMBL9712700 0.82 ALDH1A1 (0.63) TP53ALDH1A1KDM4EHSD17B10MAPT

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-5086184-A Herbicides DOWELANCO (US) 1992-02-04 US disclosed
US-4943634-A HERBICIDES ELI LILLY AND COMPANY (US) 1990-07-24 US disclosed
US-4801718-A HERBICIDES ELI LILLY AND COMPANY (US) 1989-01-31 US disclosed
US-4636243-A HERBICIDES ISOXAZOLES ELI LILLY AND COMPANY (US) 1987-01-13 US disclosed
US-4515625-A HERBICIDES ELI LILLY AND COMPANY (US) 1985-05-07 US disclosed
EP-0049071-B1 N-ARYLBENZAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1984-12-19 EP disclosed
US-4416683-A HERBICIDES ELI LILLY AND COMPANY (US) 1983-11-22 US disclosed
EP-0049071-A1 N-arylbenzamide derivatives ELI LILLY AND COMPANY (US) 1982-04-07 EP disclosed