SCHEMBL5680700

SCHEMBL5680700

CCCCc1c(C)cc(CC)c(O)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
HTT P42858 2/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KDM4E B2RXH2 3/20 0.42
PKM P14618 1/20 0.42
MAOA P21397 2/20 0.40
LDHA P00338 1/20 0.39
LDHB P07195 1/20 0.39
TYR P14679 2/20 0.39
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
POLB P06746 1/20 0.39
ALOX15 P16050 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL5676127 0.90 LDHA (0.47) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5676377 0.87 HTT (0.44) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5680945 0.86 HPGD (0.47) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5681218 0.85 HPGD (0.46) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5678454 0.83 ALOX5 (0.44) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5680854 0.83 HPGD (0.44) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5196695 0.82 NPC1 (0.50) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5676834 0.81 TYR (0.45) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5676156 0.81 ALOX5 (0.46) HPGDHTTNPC1MAPK1RAB9A
SCHEMBL5678075 0.81 ALOX5 (0.44) HPGDHTTNPC1MAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III ZHAO BAIYI 2006-02-16 US disclosed
EP-1620447-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III Exxonmobil Chemical Patents Inc. (US) 2006-02-01 EP disclosed
WO-2003102006-A1 SOLUBLE LATE TRANSITION METAL CATALYSTS FOR OLEFIN OLIGOMERIZATIONS III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2003-12-11 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 (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-20060036049-A1 Soluble late transition metal catalysts for olefin oligomerizations III COMT, CD69, SPR HPGD 2482/4885HTT 2378/4885NPC1 3879/4885

“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.