SCHEMBL918609

SCHEMBL918609

CCCCCCCCCCCCc1ccc2c(c1)C(=O)c1ccccc1C2=O

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.64
MAPT P10636 1/20 0.64
MAPK1 P28482 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
GPR3 P46089 1/20 0.59
PTPN1 P18031 1/20 0.54
LPL P06858 2/20 0.47
LIPG Q9Y5X9 2/20 0.47
RORA P35398 1/20 0.47
RORC P51449 1/20 0.47
RORB Q92753 1/20 0.47
HTR2A P28223 1/20 0.46
ELANE P08246 1/20 0.46
KAT8 Q9H7Z6 2/20 0.45
PPARA Q07869 1/20 0.45

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
SCHEMBL9062730 1.00 NPC1 (0.64) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL29531152 0.98 NPC1 (0.66) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL37031 0.98 NPC1 (0.66) NPC1ALDH1A1LMNAMAPTMAPK1
Phosphine SCHEMBL28847993 0.97 NPC1 (0.64) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL28232430 0.97 NPC1 (0.64) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL9771937 0.95 GPR3 (0.57) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL29734325 0.93 NPC1 (0.68) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL526408 0.93 NPC1 (0.68) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL8670796 0.92 NPC1 (0.66) NPC1ALDH1A1LMNAMAPTMAPK1
SCHEMBL28295158 0.91 GPR3 (0.51) NPC1ALDH1A1LMNAMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES GARDI STEFANO 2011-01-20 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
US-20090076206-A1 Additive Mixtures for Agricultural Articles CIBA SPECIALTY CHEMICALS CORP. 2009-03-19 US disclosed
CN-101151315-A Additive mixtures for agricultural articles CIBA SPECIALITY CHEMICALS S P (CH) 2008-03-26 CN disclosed
EP-1866367-A2 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2007-12-19 EP disclosed
WO-2006106049-A2 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-10-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110015295-A1 ADDITIVE MIXTURES FOR AGRICULTURAL ARTICLES ACMSD, SCD5, DEGS1 NPC1 4717/4885ALDH1A1 938/4885LMNA 699/4885
US-20090076206-A1 Additive Mixtures for Agricultural Articles SOD1, PPOX, CYBB NPC1 4034/4885ALDH1A1 1994/4885LMNA 2468/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.