SCHEMBL14639698

SCHEMBL14639698

Cc1cc(Cl)cc(Cc2ccccc2NC(=O)C2CCN(C(=O)C3CCCC3)CC2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
PTPN1 P18031 1/20 0.44
POLB P06746 2/20 0.44
GRM5 P41594 1/20 0.43
RORC P51449 3/20 0.43
DHODH Q02127 2/20 0.43
TRPV1 Q8NER1 2/20 0.42
THRB P10828 1/20 0.41
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL9965406 0.88 TRPV1 (0.51) TDP1TP53GAAMAPTPOLB
SCHEMBL9965458 0.83 TP53 (0.49) TDP1TP53GAAMAPTPOLB
SCHEMBL9965408 0.79 GAA (0.49) TDP1GAAPTPN1POLBMEN1
SCHEMBL14639571 0.79 TSHR (0.42) MAPTMEN1KMT2AL3MBTL1
SCHEMBL10173892 0.73 GAA (0.54) GAAPTPN1POLBMEN1KMT2A
SCHEMBL9965459 0.73 GAA (0.53) TDP1GAAPTPN1POLBMEN1
SCHEMBL9965441 0.70 SMN1; SMN2 (0.48) GAAMAPTPTPN1POLBGRM5
SCHEMBL9965398 0.69 SMN1; SMN2 (0.50) TDP1GAAMAPTPTPN1GRM5
SCHEMBL8300495 0.68 KMT2A (0.65) GAAPOLBTHRBKMT2A
SCHEMBL14639717 0.68 GAA (0.49) TP53GAAMAPTPOLBTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007003934-A2 17BETA-HYDR0XYSTER0ID DEHYDROGENASE TYPE 3 (17BETA-HSD3 ) INHIBITORS STERIX LIMITED (GB) 2007-01-11 WO disclosed