SCHEMBL7829858

SCHEMBL7829858

CCN(C(=O)c1c(O)c2c(Cl)c(C)ccc2[nH]c1=O)c1ccc(OC)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
TP53 P04637 2/20 0.44
THRB P10828 1/20 0.41
ALDH1A1 P00352 7/20 0.39
KDM4E B2RXH2 6/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HSD17B10 Q99714 3/20 0.39
POLB P06746 1/20 0.39
OXTR P30559 1/20 0.39
RECQL P46063 1/20 0.39
PDK2 Q15119 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL1830325 0.87 MEN1 (0.44) MAPTTP53ALDH1A1SMN1; SMN2POLB
SCHEMBL5785897 0.87 MEN1 (0.44) MAPTTP53ALDH1A1SMN1; SMN2POLB
SCHEMBL7564008 0.80 NPSR1 (0.40) MAPTTP53ALDH1A1SMN1; SMN2HPGD
SCHEMBL7556725 0.80 KMT2A (0.43) MAPTTP53ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7828963 0.78 MAPT (0.38) MAPTALDH1A1TSHRHTT
SCHEMBL7556606 0.76 MEN1 (0.43) MAPTTP53ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7557817 0.76 GPBAR1 (0.40)
SCHEMBL7558468 0.76 GPBAR1 (0.38) MAPTKDM4ESMN1; SMN2POLB
SCHEMBL7750180 0.75 MEN1 (0.45) MAPTTP53ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7559771 0.75 MEN1 (0.50) MAPTTP53ALDH1A1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095021-A1 QUINOLINE DERIVATIVES Active Biotech AB (SE) 2001-05-02 EP disclosed
WO-2000003991-A1 QUINOLINE DERIVATIVES ACTIVE BIOTECH AB (SE) 2000-01-27 WO disclosed