SCHEMBL5608250

SCHEMBL5608250

COC(=O)C12CC3(O)CC(C(=O)OC)(C1)CC(C(=O)OC)(C3)C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.35
LMNA P02545 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL5608197 0.98 NPSR1 (0.34) NPSR1LMNAMEN1KMT2ACYP4F2
SCHEMBL27153985 0.97 NPSR1 (0.37) NPSR1LMNAMEN1KMT2ACYP4F2
SCHEMBL5608339 0.95 NPSR1 (0.35) NPSR1LMNAMEN1KMT2ACYP4F2
SCHEMBL5608366 0.89 TSHR (0.41) NPSR1LMNAMEN1KMT2ATSHR
SCHEMBL9154034 0.89 NPSR1 (0.41) NPSR1LMNAMEN1KMT2ACYP4F2
SCHEMBL5084605 0.89 NPSR1 (0.41) NPSR1LMNAMEN1KMT2ACYP4F2
SCHEMBL4036133 0.85 TSHR (0.44) NPSR1LMNAMEN1KMT2ATSHR
SCHEMBL5608040 0.85 TSHR (0.41) NPSR1LMNAMEN1KMT2ATSHR
SCHEMBL1074906 0.83 LMNA (0.30) LMNA
SCHEMBL7485881 0.81 NPSR1 (0.38) NPSR1LMNAMEN1KMT2ACYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9758609-B2 Monomer, polymer, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-09-12 US disclosed
US-20160179002-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-06-23 US disclosed
EP-3035121-A2 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS Shin-Etsu Chemical Co., Ltd. (JP) 2016-06-22 EP disclosed
US-RE39744-E1 Adamantane derivatives and process for producing them DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-24 US disclosed
US-6392104-B1 CHEMICAL INTERMEDIATES FOR DRUGS, AGRICULTURE DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2002-05-21 US disclosed
EP-0927711-A1 ADAMANTANE DERIVATIVES AND PROCESS FOR PRODUCING THEM Daicel Chemical Industries, Ltd. (JP) 1999-07-07 EP 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-20160179002-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS ADH1C, ADH1A, ADH5 NPSR1 2514/4885LMNA 3230/4885MEN1 3178/4885

“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.