SCHEMBL10143992

SCHEMBL10143992

CCOc1ccc(OCc2ccc(C(=O)N(CC)CC)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 1.00
RAB9A P51151 4/20 1.00
LMNA P02545 3/20 1.00
ALDH1A1 P00352 3/20 1.00
MAPT P10636 2/20 1.00
SMN1; SMN2 Q16637 3/20 0.71
HPGD P15428 2/20 0.59
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
RXRA P19793 1/20 0.55
RXRB P28702 1/20 0.55
HRH3 Q9Y5N1 1/20 0.55
LTB4R Q15722 1/20 0.53
LTB4R2 Q9NPC1 1/20 0.53
PARP10 Q53GL7 2/20 0.53
PTPRC P08575 1/20 0.51
PTPN2 P17706 1/20 0.51
PTPN1 P18031 1/20 0.51
MAOB P27338 2/20 0.51

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
SCHEMBL4472661 0.91 NPC1 (0.82) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL94674 0.81 ALDH1A1 (0.68) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL7166974 0.78 MAPT (0.63) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL8894465 0.77 MEN1 (0.69) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL8894460 0.77 ALOX5 (0.63) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL5703500 0.76 HPGD (0.73) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL1844719 0.75 OPRM1 (0.67) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL9388919 0.75 ALDH1A1 (0.66) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL27276866 0.75 ALDH1A1 (0.60) NPC1RAB9ALMNAALDH1A1MAPT
SCHEMBL13958531 0.75 ALDH1A1 (0.59) NPC1RAB9ALMNAALDH1A1MAPT

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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS BIOMARIN PHARMACEUTICAL INC. 2012-04-26 US 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 (1 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-20120100609-A1 N-LINKED GLYCAN BIOSYNTHESIS MODULATORS ENGASE, GALNT1, GALNT13 NPC1 764/4885RAB9A 3256/4885LMNA 4109/4885

“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.