SCHEMBL7979959

SCHEMBL7979959

CNC(=O)Cc1cccc(-c2ccc(O[C@@H](C)[C@H](O)CCc3cccnc3)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 6/20 0.47
MMP12 P39900 2/20 0.42
LMNA P02545 1/20 0.41
ECE1 P42892 1/20 0.41
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
EPHX1 P07099 1/20 0.40
PSMB5 P28074 1/20 0.39
RORC P51449 1/20 0.38
WNT3A P56704 2/20 0.38
EPHX2 P34913 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
PORCN Q9H237 1/20 0.38

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
SCHEMBL7979963 1.00 PTAFR (0.47) PTAFRMMP12LMNAECE1POLB
SCHEMBL7978380 0.92 LMNA (0.46) PTAFRMMP12LMNAECE1POLB
SCHEMBL7978383 0.92 LMNA (0.46) PTAFRMMP12LMNAECE1POLB
SCHEMBL7980076 0.87 PTAFR (0.51) PTAFRLMNAPOLBHPGDHTT
SCHEMBL7966272 0.87 PTAFR (0.45) PTAFRPOLBHPGDHTTSMN1; SMN2
SCHEMBL7980074 0.87 PTAFR (0.51) PTAFRLMNAPOLBHPGDHTT
SCHEMBL7966267 0.87 PTAFR (0.45) PTAFRPOLBHPGDHTTSMN1; SMN2
SCHEMBL7976720 0.85 KCNK3 (0.43) PTAFRMMP12LMNAPOLBHPGD
SCHEMBL7976718 0.85 KCNK3 (0.43) PTAFRMMP12LMNAPOLBHPGD
SCHEMBL7976785 0.85 ECE1 (0.48) PTAFRMMP12LMNAECE1POLB

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
US-6300352-B1 FOR THERAPY OF ASTHMA ASTRAZENECA AB (SE) 2001-10-09 US claimed
US-6300352-B1 FOR THERAPY OF ASTHMA ASTRAZENECA AB (SE) 2001-10-09 US disclosed