SCHEMBL901072

SCHEMBL901072

CC1=CCC(C(C)C[C@H]2CCCC2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PTGS1 P23219 10/20 0.36
PTGS2 P35354 9/20 0.36
OPRK1 P41145 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 1/20 0.35
HPGD P15428 2/20 0.32
ALDH1A1 P00352 1/20 0.32
PTPN1 P18031 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL27214521 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL27214519 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL27231041 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL27231331 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL119790 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL27214520 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL1427225 1.00 NPC1 (0.38) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL16269456 0.84 NPC1 (0.36) NPC1RAB9ALMNASMN1; SMN2PTGS1
SCHEMBL17976872 0.84 PTPN1 (0.32) PTPN1
SCHEMBL14861496 0.83 PTGS1 (0.35) NPC1RAB9ALMNASMN1; SMN2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024083676-A1 LIPID-BASED MICROCAPSULES FIRMENICH SA (CH) 2024-04-25 WO disclosed
US-20240076583-A1 HYBRID MICROCAPSULES COMPRISING A REGENERATED BIOPOLYMER FIRMENICH SA (CH) 2024-03-07 US disclosed
WO-2023217589-A1 POLYAMIDE MICROCAPSULES FIRMENICH SA (CH) 2023-11-16 WO disclosed
WO-2023217590-A1 POLYAMIDE MICROCAPSULES FIRMENICH SA (CH) 2023-11-16 WO disclosed
EP-3898912-A1 A METHOD OF COUNTERING MALODOUR IN A WASHING MACHINE COMPRISING THE ADDITION OF A FRAGRANCE PRECURSOR Givaudan SA (CH) 2021-10-27 EP disclosed
WO-2020125922-A1 A METHOD OF COUNTERING MALODOUR IN A WASHING MACHINE COMPRISING THE ADDITION OF A FRAGRANCE PRECURSOR GIVAUDAN SA (CH) 2020-06-25 WO disclosed
EP-3003031-A1 COATED PARTICLES AND COMPOSITIONS COMPRISING SAME Vyome Biosciences Pvt Ltd (IN) 2016-04-13 EP disclosed
WO-2014195872-A1 COATED PARTICLES AND COMPOSITIONS COMPRISING SAME VYOME BIOSCIENCES PVT. LTD. (IN) 2014-12-11 WO disclosed
EP-2622051-A1 4,4-DIMETHYL-DECAL-1-ONE OR -1-OL DERIVATIVES AS PERFUMING INGREDIENTS Firmenich SA (CH) 2013-08-07 EP disclosed
WO-2012041820-A1 4,4-DIMETHYL-DECAL-1-ONE OR -1-OL DERIVATIVES AS PERFUMING INGREDIENTS FIRMENICH SA (CH) 2012-04-05 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-20240076583-A1 HYBRID MICROCAPSULES COMPRISING A REGENERATED BIOPOLYMER CRYZ, MLEC, MITF NPC1 3878/4885RAB9A 3515/4885LMNA 2568/4885

“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.