SCHEMBL19695932

SCHEMBL19695932

O=c1oc(/C=C/c2ccc(O)c(OC(F)F)c2)nc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.57
▸ NPC1 O15118 8/20 0.55
▸ RAB9A P51151 7/20 0.55
▸ KMT2A Q03164 10/20 0.51
▸ MEN1 O00255 9/20 0.51
▸ HSP90AA1 P07900 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.48
▸ ATM Q13315 1/20 0.47
▸ MAPT P10636 3/20 0.47
▸ GAA P10253 3/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ GLA P06280 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ NPSR1 Q6W5P4 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
SCHEMBL13386565 0.90 ELANE (0.61) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL13386569 0.90 ELANE (0.61) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL134146 0.86 NPC1 (0.67) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL16838646 0.81 ELANE (0.50) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL13556324 0.80 ELANE (0.65) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL1589852 0.80 NPC1 (0.72) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL1589854 0.80 NPC1 (0.72) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL12723710 0.77 NPC1 (0.72) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL16838637 0.77 KMT2A (0.44) ELANENPC1RAB9AKMT2AMEN1
SCHEMBL1590366 0.77 NPC1 (0.71) ELANENPC1RAB9AKMT2AMEN1

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-9839640-B2 Methods of treating eye diseases associated with inflammation and vascular proliferation OCCURX PTY LTD (AU) 2017-12-12 — — US disclosed
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