SCHEMBL4451765

SCHEMBL4451765

CCCCC(OC(CCCC)C(C)(C)C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.36
CA2 P00918 7/20 0.35
CA1 P00915 4/20 0.35
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 3/20 0.32
TDP1 Q9NUW8 1/20 0.32
TSHR P16473 3/20 0.31
CYP3A4 P08684 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
FDPS P14324 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
LMNA P02545 1/20 0.30
CTSK P43235 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
SCHEMBL4556906 0.92 OPRM1 (0.39) DNM1CA2TSHRFDPSLMNA
SCHEMBL29083534 0.90 LMNA (0.39) DNM1CA2TSHRFDPSLMNA
SCHEMBL1321198 0.90 LMNA (0.39) DNM1CA2TSHRFDPSLMNA
SCHEMBL2907191 0.90 LMNA (0.39) DNM1CA2TSHRFDPSLMNA
SCHEMBL1982082 0.84 DNM1 (0.36) DNM1CA2CA1MAPK1ALDH1A1
SCHEMBL8462298 0.83
SCHEMBL17793654 0.83 CA1 (0.33) CA2CA1
SCHEMBL28057052 0.82 CA2 (0.39) DNM1CA2CA1MAPK1ALDH1A1
SCHEMBL28630682 0.80 CA2 (0.38) DNM1CA2CA1MAPK1ALDH1A1
SCHEMBL19941528 0.80 CA2 (0.35) DNM1CA2CA1MAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11186531-B2 Production method for alkene KUREHA CORPORATION (JP) 2021-11-30 US disclosed
US-20210047252-A1 PRODUCTION METHOD FOR ALKENE KUREHA CORPORATION (JP) 2021-02-18 US disclosed
US-20150239796-A1 ONE POT SYNTHESIS OF 18F LABELEDTRIFLUOROMETHYLATED COMPOUNDS WITH DIFLUORO(IODO)METHANE UNIVERSITY OF OSLO (NO) 2015-08-27 US disclosed
US-7638585-B2 Catalyst flow BASF CATALYSTS, LLC (US) 2009-12-29 US disclosed
US-20090286942-A1 CATALYST FLOW BASF CATALYSTS LLC (US) 2009-11-19 US disclosed
US-7135531-B2 Spherical catalyst for olefin polymerization BASF CATALYSTS LLC (US) 2006-11-14 US disclosed
US-20050176900-A1 Spherical catalyst for olefin polymerization ENGELHARD CORPORATION 2005-08-11 US disclosed
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP disclosed
US-4748283-A POLYMERIZATION CATALYSTS LITHIUM CORPORATION OF AMERICA (US) 1988-05-31 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 (3 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-20210047252-A1 PRODUCTION METHOD FOR ALKENE ALK, ALKBH3, ALKBH1 DNM1 3753/4885CA2 772/4885CA1 886/4885
US-11186531-B2 Production method for alkene ALK, ALKBH3, ALKBH1 DNM1 3753/4885CA2 772/4885CA1 886/4885
US-20150239796-A1 ONE POT SYNTHESIS OF 18F LABELEDTRIFLUOROMETHYLATED COMPOUNDS WITH DIFLUORO(IODO)METHANE FLI1, AFF1, CYP2F1 DNM1 203/4885CA2 3055/4885CA1 1196/4885

“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.