SCHEMBL8356499

SCHEMBL8356499

COC(=O)c1sccc1NC(=O)CN1CCN(c2ncccc2C(F)(F)F)CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.61
▸ MAPK10 P53779 3/20 0.61
▸ MAPT P10636 2/20 0.61
▸ LMNA P02545 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ POLB P06746 1/20 0.52
▸ HTR1A P08908 1/20 0.49
▸ HTR7 P34969 1/20 0.49
▸ MAPK8 P45983 2/20 0.48
▸ MAPK9 P45984 1/20 0.48
▸ GAA P10253 2/20 0.48
▸ RBP4 P02753 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ HSD11B1 P28845 1/20 0.45
▸ TRPV1 Q8NER1 2/20 0.45

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
SCHEMBL8358036 0.84 POLB (0.72) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL8351326 0.79 MAPT (0.62) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL8358322 0.78 TSHR (0.71) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL8354074 0.78 MAPT (0.68) MAPK1MAPK10MAPTLMNATSHR
Hydrochloric Acid SCHEMBL8351225 0.78 MAPT (0.67) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL8351821 0.75 MAPK10 (0.56) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL31531433 0.75 MAPK10 (0.69) MAPK1MAPK10MAPTLMNATSHR
SCHEMBL4001578 0.75 DRD4 (0.69) MAPK1MAPTLMNAHSD17B10GAA
SCHEMBL4005288 0.74 MAPK1 (0.70) MAPK1MAPTLMNATSHRPOLB
Hydrochloric Acid SCHEMBL1375801 0.73 HSD11B1 (0.65) MAPK1GAARBP4HSD11B1TRPV1

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
WO-1999031096-A1 PIPERAZINE DERIVATIVES USEFUL AS HYPOGLYCEMIC AGENTS SHAMAN PHARMACEUTICALS, INC. (US) 1999-06-24 — — WO disclosed
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