SCHEMBL9750132

SCHEMBL9750132

CCCCCCCCCCCCOC(O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 3/20 0.49
NAAA Q02083 2/20 0.46
TSHR P16473 2/20 0.45
ALDH1A1 P00352 2/20 0.45
ASAH1 Q13510 2/20 0.44
TP53 P04637 1/20 0.44
PLA2G4B P0C869 2/20 0.43
LTA4H P09960 1/20 0.43
ACER2 Q5QJU3 1/20 0.43

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
SCHEMBL28403155 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL10430492 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL29211021 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL9750029 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL4850677 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL28706904 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL10618772 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL28903655 1.00 NPC1 (0.51) NPC1RAB9ASMN1; SMN2LMNANAAA
SCHEMBL9252653 0.98 LMNA (0.50) NPC1RAB9ASMN1; SMN2LMNANAAA
Benzene SCHEMBL28115200 0.98 LMNA (0.50) NPC1RAB9ASMN1; SMN2LMNANAAA

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-20190292215-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE SPEROVIE BIOSCIENCES, INC. 2019-09-26 US disclosed
CN-103936960-B A kind of polyurethane associative thickener and preparation method thereof and application SOUTH CHINA UNIVERSITY OF TECHNOLOGY (CN) 2015-12-02 CN disclosed
CN-103936960-A Polyurethane associated thickener, and preparation method and application thereof UNIV SOUTH CHINA TECH 2014-07-23 CN disclosed
EP-0315912-B1 SEBOSUPPRESSIVE PREPARATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 1992-06-17 EP disclosed
EP-0315912-A1 Sebosuppressive preparations Henkel Kommanditgesellschaft auf Aktien (DE) 1989-05-17 EP 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-20190292215-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR THE TREATMENT OF DISEASE STING1, CGAS, MYD88 NPC1 423/4885RAB9A 3019/4885SMN1; SMN2 1722/4885

“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.