SCHEMBL1740337

SCHEMBL1740337

CCC(CC)OC(=O)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP24A1 Q07973 1/20 0.38
AHR P35869 1/20 0.34
ALDH1A1 P00352 2/20 0.34
TBXAS1 P24557 3/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
CYP17A1 P05093 2/20 0.32
FAAH O00519 1/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL1199383 0.91 PRKCA (0.38) CYP24A1AHRALDH1A1TBXAS1LMNA
SCHEMBL1490570 0.85 CYP24A1 (0.38) CYP24A1AHRALDH1A1TBXAS1LMNA
SCHEMBL38661546 0.84 CYP24A1 (0.38) CYP24A1AHRTBXAS1CYP17A1
SCHEMBL31053780 0.84 CYP24A1 (0.38) CYP24A1AHRTBXAS1CYP17A1
SCHEMBL24587752 0.83 TBXAS1 (0.38) CYP24A1AHRTBXAS1
SCHEMBL25299195 0.82 TBXAS1 (0.41) CYP24A1TBXAS1SMN1; SMN2
SCHEMBL24587767 0.82 TBXAS1 (0.41) CYP24A1TBXAS1SMN1; SMN2
SCHEMBL38660965 0.82 TBXAS1 (0.41) CYP24A1TBXAS1SMN1; SMN2
SCHEMBL38662147 0.82 TBXAS1 (0.41) CYP24A1TBXAS1SMN1; SMN2
SCHEMBL24587006 0.82 TBXAS1 (0.41) CYP24A1TBXAS1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118574808-A Ionizable amine lipids and lipid nanoparticles 比姆医疗股份有限公司 2024-08-30 CN disclosed
US-20110319396-A1 BENZODIAZEPIN-2-ON DERIVATIVES MSD K.K. (JP) 2011-12-29 US disclosed
CN-102282158-A Azepinone derivatives 2011-12-14 CN disclosed
EP-2389366-A1 BENZODIAZEPIN-2-ON DERIVATIVES MSD K.K. (JP) 2011-11-30 EP disclosed
US-8040502-B2 Optical inspection of flat media using direct image technology WDI WISE DEVICE INC. (CA) 2011-10-18 US disclosed
US-20110212891-A1 AZEPINONE DERIVATIVES MSD K.K. 2011-09-01 US disclosed
US-20110212891-A1 AZEPINONE DERIVATIVES MSD K.K. 2011-09-01 US disclosed
WO-2010084979-A1 BENZODIAZEPIN-2-ON DERIVATIVES BANYU PHARMACEUTICAL CO.,LTD. (JP) 2010-07-29 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 (2 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-20110212891-A1 AZEPINONE DERIVATIVES AZI2, NDUFS3, RPS4Y1 CYP24A1 1963/4885AHR 2253/4885ALDH1A1 735/4885
US-20110319396-A1 BENZODIAZEPIN-2-ON DERIVATIVES DGAT1, DGAT2, GRIN1 CYP24A1 1576/4885AHR 2733/4885ALDH1A1 1126/4885

“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.