SCHEMBL170528

SCHEMBL170528

CC1CCC(OC(=O)C2CCC(C3CCC(C)CC3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.38
ALDH1A1 P00352 3/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 2/20 0.31
TP53 P04637 1/20 0.31
ALOX15 P16050 1/20 0.30
HCRTR2 O43614 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL20152491 1.00 CYP19A1 (0.38) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20152488 1.00 CYP19A1 (0.38) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL13074339 1.00 CYP19A1 (0.38) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20152489 1.00 CYP19A1 (0.38) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL14274401 1.00 CYP19A1 (0.38) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20152479 0.94 CYP19A1 (0.41) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20152474 0.94 CYP19A1 (0.41) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20152476 0.94 CYP19A1 (0.41) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20275995 0.94 CYP19A1 (0.41) CYP19A1ALDH1A1NPC1LMNAMAPT
SCHEMBL20276012 0.94 CYP19A1 (0.41) CYP19A1ALDH1A1NPC1LMNAMAPT

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 189 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12043782-B2 Liquid crystalline medium MERCK PATENT GMBH (DE) 2024-07-23 US disclosed
WO-2024133363-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2024-06-27 WO disclosed
US-20240067879-A1 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-02-29 US disclosed
US-20240067879-A1 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-02-29 US disclosed
US-11873438-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2024-01-16 US disclosed
US-11820932-B2 Polymerisable liquid crystal material and polymerised liquid crystal film MERCK PATENT GMBH (DE) 2023-11-21 US disclosed
US-20230357637-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-11-09 US disclosed
US-20230357637-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-11-09 US disclosed
EP-4273207-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2023-11-08 EP disclosed
US-20230323209-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2023-10-12 US disclosed
WO-2008009417-A1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2008-01-24 WO disclosed
US-20080020148-A1 Chromane Derivatives Method for Production and the Use Thereof MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-01-24 US disclosed
US-7314653-B2 Liquid-crystal medium and electro-optical display containing same MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2008-01-01 US disclosed
US-7270856-B2 Cyclobutane derivatives MERCK PATENT GMBH (DE) 2007-09-18 US disclosed
EP-1570024-B1 FAST SWITCHING LIQUID CRYSTAL COMPOSITIONS FOR USE IN BISTABLE LIQUID CRYSTAL DEVICES MERCK PATENT GMBH (DE) 2007-08-01 EP disclosed
EP-1411104-B1 Liquid crystalline compounds with a -CHFO- bridge MERCK PATENT GMBH (DE) 2007-05-16 EP disclosed
US-20070080324-A1 mixture of polar compounds of negative dielectric anisotropy; electro-optical display with active-matrix addressing based on the ECB(electrically controlled birefringence), PALC (positive charge assisted leakage current) or IPS ( in plane switching) effect MERCK PATENT GMBH (DE) 2007-04-12 US disclosed
US-20070080325-A1 Liquid crystal composition for use in bistable liquid crystal devices MERCK PATENT GMBH (DE) 2007-04-12 US disclosed
US-20070051920-A1 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2007-03-08 US disclosed
US-4229315-A FOR DISPLAY ELEMENTS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1980-10-21 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-20080020148-A1 Chromane Derivatives Method for Production and the Use Thereof C1S, CHRM1, C1R CYP19A1 142/4885ALDH1A1 1239/4885NPC1 1743/4885

“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.