SCHEMBL7214451

SCHEMBL7214451

C=C(C)C(=O)OC(CCOCC(C)O)c1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25409231 0.82 NPC1 (0.36) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL1923120 0.73 NPC1 (0.40) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL345853 0.72 MAPT (0.35) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL132431 0.72 CACNA1A (0.40) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL2777176 0.72 NPC1 (0.41) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL29384951 0.72 GAA (0.37) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL110871 0.72 GAA (0.37) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL93408 0.72 NPC1 (0.37) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL29384286 0.72 NPC1 (0.37) NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL7155869 0.72 CACNA1A (0.38) NPC1RAB9AALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0899590-B1 Ultraviolet absorbing base material NIDEK KK (JP) 2003-03-19 EP claimed
US-6096846-A Ultraviolet absorbing base material NIDEK CO., LTD. (JP) 2000-08-01 US claimed
EP-0899590-A2 Ultraviolet absorbing base material NIDEK CO., LTD (JP) 1999-03-03 EP claimed
EP-0899590-B1 Ultraviolet absorbing base material NIDEK KK (JP) 2003-03-19 EP disclosed
US-6096846-A Ultraviolet absorbing base material NIDEK CO., LTD. (JP) 2000-08-01 US disclosed
JP-2000007735-A ULTRAVIOLET-ABSORBING MATERIAL NIDEK CO LTD 2000-01-11 JP disclosed
EP-0899590-A2 Ultraviolet absorbing base material NIDEK CO., LTD (JP) 1999-03-03 EP disclosed