SCHEMBL5526720

SCHEMBL5526720

CCCCCCOc1ccc(CC)cc1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.66
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
HRH3 Q9Y5N1 1/20 0.58
LTA4H P09960 3/20 0.58
TP53 P04637 2/20 0.58
HPGD P15428 2/20 0.58
TSHR P16473 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
MAPT P10636 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
PLA2G4B P0C869 2/20 0.56

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
SCHEMBL9072656 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL11864814 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL14608534 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL12302872 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL13242054 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL23350372 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL11339167 1.00 NR5A1 (0.66) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL8348497 0.98 NR5A1 (0.62) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL12199924 0.94 RARB (0.61) NR5A1NPC1RAB9AHRH3LTA4H
SCHEMBL17445914 0.94 HRH3 (0.64) NR5A1HRH3HPGDALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10966967-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-04-06 US disclosed
US-20200281905-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-09-10 US disclosed
US-10695328-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-30 US disclosed
US-20190314346-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-10-17 US disclosed
CN-110283184-A IDTV organic micromolecule and the preparation method and application thereof 湘潭大学 2019-09-27 CN disclosed
US-9663466-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 US disclosed
US-8329377-B2 Imide compound and chemically amplified resist composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-12-11 US disclosed
US-8173350-B2 Oxime compound and resist composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-8173353-B2 Sulfonium compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-20100248135-A1 SULFONIUM COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-30 US disclosed
US-20100028807-A1 Imide Compound and Chemically Amplified Resist Composition Containing The Same SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2010-02-04 US disclosed
US-20100021847-A1 Oxime Compound and Resist Composition Containing the Same SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2010-01-28 US disclosed
US-20080312435-A1 Imine Compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-18 US disclosed
US-20080160521-A1 BENZIMIDAZOLIUM DYES AND THEIR USE AS FLUORESCENT CHEMOSENSORS NEW YORK UNIVERSITY (US) 2008-07-03 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 (9 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-20080312435-A1 Imine Compound CNR1, CNR2, HRH4 NR5A1 977/4885NPC1 1485/4885RAB9A 841/4885
US-20190314346-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 NR5A1 550/4885NPC1 97/4885RAB9A 1973/4885
US-20080160521-A1 BENZIMIDAZOLIUM DYES AND THEIR USE AS FLUORESCENT CHEMOSENSORS IK, C9, CBR3 NR5A1 3643/4885NPC1 3372/4885RAB9A 4549/4885
US-20100248135-A1 SULFONIUM COMPOUND PFAS, F12, AFF1 NR5A1 1272/4885NPC1 2047/4885RAB9A 3545/4885
US-20100028807-A1 Imide Compound and Chemically Amplified Resist Composition Containing The Same IGF1R, CCNA1, MYC NR5A1 683/4885NPC1 2119/4885RAB9A 1049/4885
US-10966967-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors DGAT2, MGAT2, MGAT1 NR5A1 550/4885NPC1 97/4885RAB9A 1973/4885
US-10695328-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors DGAT2, MGAT2, MGAT1 NR5A1 550/4885NPC1 97/4885RAB9A 1973/4885
US-20200281905-A1 ARYL DIHYDROPYRIDINONES AND PIPERIDINONE MGAT2 INHIBITORS DGAT2, MGAT2, MGAT1 NR5A1 550/4885NPC1 97/4885RAB9A 1973/4885
US-20100021847-A1 Oxime Compound and Resist Composition Containing the Same CYC1, UQCRB, CBR1 NR5A1 987/4885NPC1 3617/4885RAB9A 3530/4885

“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.