SCHEMBL7447235

SCHEMBL7447235

Cc1ccc(Cl)c(NC(=O)CN2CCC(NCC(O)C3COc4ccccc4O3)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AIMP2 Q13155 1/20 0.48
POLB P06746 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 2/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
MAPT P10636 1/20 0.43
GAA P10253 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTT P42858 1/20 0.40

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
SCHEMBL10998896 0.88 AIMP2 (0.54) AIMP2POLBALDH1A1MEN1KMT2A
SCHEMBL7447128 0.87 RAB9A (0.52) POLBALDH1A1MEN1KMT2ANPSR1
SCHEMBL7433767 0.86 DRD4 (0.53) ALDH1A1
SCHEMBL7435451 0.85 RAB9A (0.51) POLBALDH1A1MEN1KMT2ANPSR1
SCHEMBL7435698 0.85 AIMP2 (0.48) AIMP2POLBALDH1A1NPSR1LMNA
SCHEMBL7436573 0.84 HTT (0.47) POLBALDH1A1MEN1KMT2ANPSR1
SCHEMBL7436396 0.84 AIMP2 (0.42) AIMP2POLBALDH1A1NPSR1LMNA
SCHEMBL7436389 0.83 MAPT (0.45) AIMP2POLBALDH1A1MEN1KMT2A
SCHEMBL7436669 0.83 ALDH1A1 (0.52) AIMP2POLBALDH1A1NPSR1LMNA
SCHEMBL7435917 0.83 POLB (0.48) AIMP2POLBALDH1A1NPSR1LMNA

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
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed