SCHEMBL2162004

SCHEMBL2162004

CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC(=O)[C@](C)(CCCO)[C@H]3CC[C@]12C

nearest known ligand 0.78

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 7/20 0.78
▸ FNTB P49356 7/20 0.78
▸ SRD5A1 P18405 6/20 0.58
▸ SRD5A2 P31213 3/20 0.58
▸ NPC1L1 Q9UHC9 3/20 0.57
▸ USP2 O75604 2/20 0.57
▸ LMNA P02545 1/20 0.57
▸ CDC25A P30304 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52

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
SCHEMBL2162264 0.97 FNTA (0.77) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL14722419 0.95 FNTA (0.80) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL4736266 0.90 FNTA (0.78) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL1311793 0.89 FNTA (0.81) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL14721324 0.89 FNTA (0.64) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL2162860 0.89 FNTA (0.80) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL2162288 0.89 FNTA (0.74) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL2161763 0.88 FNTA (1.00) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL17817386 0.88 FNTA (1.00) FNTAFNTBSRD5A1SRD5A2NPC1L1
SCHEMBL1310374 0.88 FNTA (0.85) FNTAFNTBSRD5A1SRD5A2NPC1L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160339041-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2016-11-24 — — US claimed
US-20150056269-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2015-02-26 — — US claimed
EP-2747750-A2 LIPOSOME COMPRISING AT LEAST A CHOLESTEROL DERIVATIVE Trophos (FR) 2014-07-02 — — EP claimed
WO-2013026989-A2 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2013-02-28 — — WO claimed
US-20160339041-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2016-11-24 — — US disclosed
EP-1991235-B1 USE OF 3,5-SECO-4-NORCHOLESTANE DERIVATIVES FOR OBTAINING A CYTOPROTECTIVE MEDICAMENT TROPHOS (FR) 2016-11-02 — — EP disclosed
US-9045393-B2 Derivatives of 3.5-seco-4-norcholestane and use thereof TROPHOS (FR) 2015-06-02 — — US disclosed
US-20150056269-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2015-02-26 — — US disclosed
EP-2747750-A2 LIPOSOME COMPRISING AT LEAST A CHOLESTEROL DERIVATIVE Trophos (FR) 2014-07-02 — — EP disclosed
WO-2013026989-A2 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE TROPHOS (FR) 2013-02-28 — — WO disclosed
EP-1786759-B1 NOVEL DERIVATIVES OF 3,5-SECO-4-NORCHOLESTANE AND USE THEREOF TROPHOS (FR) 2012-07-04 — — EP disclosed
US-7985774-B2 Use of 3,5-seco-4-nor-cholestane derivatives for obtaining a cytoprotective drug TROPHOS (FR) 2011-07-26 — — US disclosed
US-20090312434-A1 USE OF 3,5-SECO-4-NOR-CHOLESTANE DERIVATIVES FOR OBTAINING A CYTOPROTECTIVE DRUG TROPHOS (FR) 2009-12-17 — — US disclosed
EP-1991235-A1 USE OF 3,5-SECO-4-NORCHOLESTANE DERIVATIVES FOR OBTAINING A CYTOPROTECTIVE MEDICAMENT Trophos (FR) 2008-11-19 — — EP disclosed
US-20080275130-A1 Novel Derivatives of 3.5-Seco-4-Norcholestane and Use Thereof TROPHOS (FR) 2008-11-06 — — US disclosed
WO-2008056059-A2 4-AZASTEROL DERIVATIVES, METHODS FOR THE SYNTHESIS THEREOF AND USE OF SAME AS DRUGS TROPHOS (FR) 2008-05-15 — — WO disclosed
WO-2007101925-A1 USE OF 3,5-SECO-4-NORCHOLESTANE DERIVATIVES FOR OBTAINING A CYTOPROTECTIVE MEDICAMENT TROPHOS (FR) 2007-09-13 — — WO disclosed
EP-1786759-A1 NOVEL DERIVATIVES OF 3,5-SECO-4-NORCHOLESTANE AND USE THEREOF Trophos (FR) 2007-05-23 — — EP disclosed
WO-2006027454-A1 NOVEL DERIVATIVES OF 3,5-SECO-4-NORCHOLESTANE AND USE THEREOF TROPHOS (FR) 2006-03-16 — — 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 (4 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-20160339041-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE LIPA, NPC1L1, CETP FNTA 120/4885FNTB 906/4885SRD5A1 1025/4885
US-20080275130-A1 Novel Derivatives of 3.5-Seco-4-Norcholestane and Use Thereof HSD3B1, HSD3B2, CYP11B1 FNTA 1004/4885FNTB 1178/4885SRD5A1 10/4885
US-20090312434-A1 USE OF 3,5-SECO-4-NOR-CHOLESTANE DERIVATIVES FOR OBTAINING A CYTOPROTECTIVE DRUG NR1H4, CYP27A1, NPC1 FNTA 574/4885FNTB 635/4885SRD5A1 126/4885
US-20150056269-A1 LIPOSOME COMPRISING AT LEAST ONE CHOLESTEROL DERIVATIVE LIPA, NPC1L1, CETP FNTA 120/4885FNTB 906/4885SRD5A1 1025/4885

“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.

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