SCHEMBL6584820

SCHEMBL6584820

COc1ccc(-c2cc(NC(=O)C(C)c3ccc(-c4ccccc4)c(F)c3)n[nH]2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
MAPT P10636 3/20 0.55
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
NPY5R Q15761 3/20 0.52
PTGS1 P23219 3/20 0.50
PTGS2 P35354 3/20 0.50
CYP2C19 P33261 2/20 0.50
AKR1C3 P42330 2/20 0.50
AKR1C2 P52895 2/20 0.50
FAAH O00519 1/20 0.50
FABP2 P12104 1/20 0.50
TSHR P16473 1/20 0.50
AKR1C4 P17516 1/20 0.50
ADRA2B P18089 1/20 0.50
CHRM3 P20309 1/20 0.50
HTR2C P28335 1/20 0.50

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
SCHEMBL6583416 0.82 NPY5R (0.53) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5319600 0.81 LMNA (0.73) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5319592 0.81 LMNA (0.73) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6585213 0.79 NPY5R (0.55) LMNASMN1; SMN2MAPTNPY5RFAAH
SCHEMBL8320075 0.76 APP (0.72) LMNAMEN1KMT2AMAPTPTGS1
SCHEMBL6583819 0.75 AKR1C3 (0.47) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6584499 0.73 NPY5R (0.56) NPY5R
SCHEMBL28689425 0.72 LMNA (0.80) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL13704166 0.72 LMNA (1.00) LMNASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6583814 0.71 AKR1C3 (0.47) LMNASMN1; SMN2MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945440-B1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-05-26 EP claimed
US-6180653-B1 EATING DISORDERS; DIETETICS; ANTIDIABETIC AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-01-30 US claimed
EP-0945440-A1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP claimed
EP-0945440-B1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-05-26 EP disclosed
US-6180653-B1 EATING DISORDERS; DIETETICS; ANTIDIABETIC AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 2001-01-30 US disclosed
EP-0945440-A1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed