SCHEMBL8543993

SCHEMBL8543993

CCOC(=O)c1c(N(C)CC(=O)c2ccccc2Cc2ccccc2)c2c(Cl)cc(Cl)cc2n1C(=O)OC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.45
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
TSHR P16473 1/20 0.34
PDE3B Q13370 3/20 0.33
PDE3A Q14432 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL8538965 0.88 MDM2 (0.46) MDM2CRHBPCRHR2SMN1; SMN2LMNA
SCHEMBL8547263 0.87 MDM2 (0.42) MDM2CRHBPCRHR2TSHRSMN1; SMN2
SCHEMBL8541107 0.85 MDM2 (0.47) MDM2CRHBPCRHR2TSHRPDE3B
SCHEMBL8540705 0.84 MDM2 (0.45) MDM2TSHRSMN1; SMN2LMNAKDM4E
SCHEMBL8543997 0.83 MDM2 (0.43) MDM2CRHBPCRHR2TSHRPDE3B
SCHEMBL8546091 0.82 MDM2 (0.42) MDM2SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL8540739 0.81 MDM2 (0.41) MDM2LMNAALDH1A1MAPT
SCHEMBL8546214 0.81 MDM2 (0.49) MDM2CRHBPCRHR2TSHRKDM4E
SCHEMBL8545611 0.81 MDM2 (0.41) MDM2TSHRSMN1; SMN2LMNAALDH1A1
SCHEMBL8541906 0.80 MDM2 (0.44) MDM2CRHBPCRHR2SMN1; SMN2LMNA

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