SCHEMBL8545284

SCHEMBL8545284

CCOC(=O)c1c(NCC(=O)c2ccc(F)cc2)c2c(Cl)cc(Cl)cc2n1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 6/20 0.43
SMN1; SMN2 Q16637 1/20 0.37
ELANE P08246 1/20 0.36
MAPT P10636 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MDM4 O15151 1/20 0.35
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
CASP3 P42574 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
LMNA P02545 1/20 0.34
ACHE P22303 2/20 0.34
BCHE P06276 1/20 0.34
DGAT2 Q96PD7 1/20 0.33
ALOX15 P16050 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL8540675 0.94 MDM2 (0.46) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8540513 0.92 MDM2 (0.48) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8541669 0.92 MDM2 (0.42) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8544760 0.92 MDM2 (0.42) MDM2SMN1; SMN2MAPTALDH1A1KMT2A
SCHEMBL8546095 0.92 MDM2 (0.39) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8545420 0.89 MDM2 (0.44) MDM2MAPTALDH1A1KMT2AMEN1
SCHEMBL8540708 0.85 MDM2 (0.42) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8538967 0.83 MDM2 (0.44) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8545614 0.83 MDM2 (0.38) MDM2SMN1; SMN2ELANEMAPTALDH1A1
SCHEMBL8540741 0.83 MDM2 (0.38) MDM2SMN1; SMN2MAPTALDH1A1KMT2A

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-0483881-B1 3-Amidoindolyl derivatives MERRELL PHARMA INC (US) 1998-01-21 EP disclosed
US-5703107-A CENTRAL NERVOUS SYSTEM DISORDERS; ANALGESICS; ANTIEPILEPTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1997-12-30 US disclosed
US-5675018-A 3-amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1997-10-07 US disclosed
US-5491153-A 3-amidoindolyl derivative MERRELL DOW PHARMACEUTICALS INC. (US) 1996-02-13 US disclosed
US-5189054-A 3-amidoindolyl derivatives and pharmaceutical compositions thereof MERRELL DOW PHARMACEUTICALS INC. (US) 1993-02-23 US disclosed
EP-0483881-A1 3-Amidoindolyl derivatives MERRELL PHARMACEUTICALS INC. (US) 1992-05-06 EP disclosed