SCHEMBL7238448

SCHEMBL7238448

NNC(=O)c1cccc(OC(F)(F)C(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
RAB9A P51151 3/20 0.55
NPC1 O15118 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
HTT P42858 2/20 0.51
BRAF P15056 2/20 0.50
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
GPR139 Q6DWJ6 1/20 0.46
KAT6A Q92794 1/20 0.45
ATM Q13315 1/20 0.44
EPHX2 P34913 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.43

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
SCHEMBL31180472 0.86 KAT6A (0.58) ALDH1A1KDM4EKMT2AGPR139KAT6A
SCHEMBL679553 0.86 KAT6A (0.58) ALDH1A1KDM4EKMT2AGPR139KAT6A
Hydrochloric Acid SCHEMBL30978290 0.85 KAT6A (0.56) ALDH1A1KDM4EKMT2AGPR139KAT6A
SCHEMBL6580853 0.84 KMT2A (0.61) MAPTRAB9ANPC1SMN1; SMN2HTT
Hydrochloric Acid SCHEMBL20166696 0.83 KMT2A (0.59) MAPTRAB9ANPC1SMN1; SMN2HTT
SCHEMBL4492988 0.83 RAB9A (0.63) MAPTRAB9ANPC1SMN1; SMN2HTT
SCHEMBL10664357 0.81 TRPV1 (0.61) MAPTHTTALDH1A1KDM4EKMT2A
SCHEMBL978712 0.81 AKR1C3 (0.54) MAPTRAB9ANPC1SMN1; SMN2HTT
SCHEMBL4035515 0.81 MAPT (0.56) MAPTRAB9ANPC1SMN1; SMN2HTT
SCHEMBL5866992 0.80 MAPT (0.49) MAPTRAB9ANPC1SMN1; SMN2HTT

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
US-6613942-B1 Nonpeptide; 4-hydroxy benzoic acid hydrazides NOVO NORDISK A/S (DK) 2003-09-02 US disclosed