SCHEMBL448363

SCHEMBL448363

CCC(C)(C)c1ccc(C(=O)OC(=O)c2ccc(C(C)(C)CC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
POLB P06746 1/20 0.48
CYP2C9 P11712 1/20 0.48
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 2/20 0.43
MAPK1 P28482 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CA12 O43570 1/20 0.40
ESR1 P03372 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
ESR2 Q92731 1/20 0.40
CA14 Q9ULX7 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
SCHEMBL448364 0.93 NPC1 (0.54) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL26303152 0.91 NPC1 (0.44) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL28866176 0.87 NPC1 (0.47) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL1794289 0.87 MAPT (0.56) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL1790586 0.85 CA1 (0.59) NPC1RAB9AMAPTTDP1MAPK1
SCHEMBL14666430 0.85 CA1 (0.47) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL446031 0.83 SHBG (0.55) MAPTSMN1; SMN2CYP3A4
SCHEMBL10455979 0.82 MAPT (0.50) NPC1RAB9APOLBCYP2C9MAPT
SCHEMBL446032 0.81 CNR2 (0.48) NPC1RAB9AMAPTALDH1A1
SCHEMBL3435838 0.80 EPHX2 (0.49) NPC1RAB9APOLBCYP2C9MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9290868-B2 Biodegradable nonwoven fabric and fiber product using the same JNC CORPORATION (JP) 2016-03-22 US disclosed
EP-2422005-B1 BIODEGRADABLE NONWOVEN FABRIC AND FIBER PRODUCT USING THE SAME JNC CORP (JP) 2013-12-04 EP disclosed
US-20120064789-A1 BIODEGRADABLE NONWOVEN FABRIC AND FIBER PRODUCT USING THE SAME JNC CORPORATION (JP) 2012-03-15 US disclosed
EP-2422005-A1 BIODEGRADABLE NONWOVEN FABRIC AND FIBER PRODUCT USING THE SAME JNC Corporation (JP) 2012-02-29 EP disclosed
WO-2010122806-A1 BIODEGRADABLE NONWOVEN FABRIC AND FIBER PRODUCT USING THE SAME CHISSO CORPORATION (JP) 2010-10-28 WO disclosed