SCHEMBL769842

SCHEMBL769842

CC(=O)Oc1ccc(CCSCCCC(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
LMNA P02545 1/20 0.40
PTGS2 P35354 2/20 0.39
ELANE P08246 2/20 0.39
GAA P10253 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
GLS O94925 2/20 0.37
THRB P10828 2/20 0.37
PPARA Q07869 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
HIF1A Q16665 1/20 0.36
EPAS1 Q99814 1/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36

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
SCHEMBL11960785 0.82 LMNA (0.50) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL770505 0.81 CALM1 (0.45) GAA
SCHEMBL770492 0.81 SMN1; SMN2 (0.45) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL770348 0.80 PPARA (0.37) SMN1; SMN2PPARA
SCHEMBL770265 0.78 SMN1; SMN2 (0.43) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL17354076 0.78 SMN1; SMN2 (0.43) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL770351 0.75 CYP1A2 (0.52) POLBKMT2AMEN1
SCHEMBL23894744 0.75 LMNA (0.57) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL9081470 0.75 LMNA (0.61) NPC1RAB9ASMN1; SMN2LMNAPTGS2
SCHEMBL8565931 0.72 NPC1 (0.61) NPC1RAB9ASMN1; SMN2LMNAPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9217921-B2 Resist underlayer film forming composition containing silicon having sulfide bond NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-22 US disclosed
US-20120070994-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SILICON HAVING SULFIDE BOND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2012-03-22 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-20120070994-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SILICON HAVING SULFIDE BOND SMC3, SRSF3, SRSF9 NPC1 3432/4885RAB9A 916/4885SMN1; SMN2 3522/4885

“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.