SCHEMBL8487378

SCHEMBL8487378

COC(=O)C(CCN(c1c(Cl)c(C)cc2nc(OC)c(OC)nc12)S(C)(=O)=O)c1ccc2ccccc2c1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 17/20 0.34
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MCHR1 Q99705 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
SCHEMBL8488133 0.78 GRIN1 (0.39) MEN1KMT2A
SCHEMBL8488434 0.75 GRIN1 (0.43) MEN1KMT2A
SCHEMBL8485125 0.75 ALDH1A1 (0.48) MEN1KMT2A
SCHEMBL8488905 0.75 ALDH1A1 (0.38) MEN1KMT2A
SCHEMBL8488354 0.75 GRIN1 (0.40) MEN1KMT2A
SCHEMBL8485738 0.72 SMN1; SMN2 (0.36) MEN1KMT2A
SCHEMBL8930635 0.70 GRIN1 (0.36) MEN1KMT2A
SCHEMBL8484920 0.69 GRIN1 (0.59)
SCHEMBL8650855 0.68 GRIN1 (0.42) MEN1KMT2A
SCHEMBL7470510 0.66 RAB9A (0.46) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5863917-A ANXIOLYTIC AGENT, ANTICONVULSANTS, ANALGESICS AND NEUROPROTECTIVES. PFIZER, INC. (US) 1999-01-26 US disclosed
WO-1997031902-A1 QUINOXALINE DERIVATIVES USEFUL IN THERAPY PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) 1997-09-04 WO disclosed
EP-0792874-A1 Quinoxaline derivatives useful in therapy Pfizer Limited (GB) 1997-09-03 EP disclosed