SCHEMBL6282686

SCHEMBL6282686

COC1(OC)CCCC1=O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 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
SCHEMBL3676099 0.93 GRIN1 (0.34) TSHR
SCHEMBL12499996 0.91 GRIN1 (0.33) TSHR
SCHEMBL29013944 0.69 GRIN1 (0.36) TSHR
SCHEMBL7619912 0.69 SLC6A4 (0.30)
SCHEMBL7776154 0.68
SCHEMBL10888167 0.68
SCHEMBL11164661 0.68 TSHR (0.40) TSHR
SCHEMBL3027835 0.67
SCHEMBL23168690 0.67 GRIN1 (0.33) TSHR
SCHEMBL1627516 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102763254-B High energy density redox flow device MASSACHUSETTS INST TECHNOLOGY 2015-07-08 CN disclosed
CN-104701504-A High energy density redox flow device MASSACHUSETTS INST TECHNOLOGY 2015-06-10 CN disclosed
CN-102763254-A High energy density redox flow device MASSACHUSETTS INST TECHNOLOGY 2012-10-31 CN disclosed
US-6960573-B2 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED (JP) 2005-11-01 US disclosed
US-6867313-B2 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED (JP) 2005-03-15 US disclosed
US-6689766-B2 ALSO FOR TREATING MALIGNANT TUMORS, RHEUMATOID ARTHRITIS, OSTEOPOROSIS, DIABETES MELLITUS, HYPERTENSION, ALOPECIA, ACNE, PSORIASIS, DERMATITIS, HYPERCALCEMIA, HYPOPARATHYROIDISM AND METABOLIC DISORDER OF CARTILAGE. TEIJIN LIMITED (JP) 2004-02-10 US disclosed
US-6548489-B2 Also for treating malignant tumors, rheumatoid arthritis, osteoporosis, diabetes mellitus, hypertension, alopecia, acne, psoriasis, dermatitis, hypercalcemia, hypoparathyroidism and metabolic disorder of cartilage. TEIJIN LIMITED (JP) 2003-04-15 US disclosed
US-6531460-B1 Vitamin D3 derivatives TEIJIN LIMITED (JP) 2003-03-11 US disclosed
US-20020132799-A1 Vitamin D3 dervative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED 2002-09-19 US disclosed
US-20020103173-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED 2002-08-01 US disclosed
US-20020099039-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED 2002-07-25 US disclosed
US-20020091109-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same TEIJIN LIMITED 2002-07-11 US disclosed
EP-1123921-A1 VITAMIN D 3? DERIVATIVES AND REMEDIES FOR INFLAMMATORY RESPIRATORY DISEASES CONTAINING THE SAME TEIJIN LIMITED (JP) 2001-08-16 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 (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-20020103173-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same CYP24A1, VDR, CYP2R1 MAPT 4228/4885CYP2C9 1626/4885TSHR 256/4885
US-20020132799-A1 Vitamin D3 dervative and treating agent for inflammatory respiratory disease using same CYP24A1, VDR, CYP2R1 MAPT 4371/4885CYP2C9 2268/4885TSHR 307/4885
US-20020099039-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same CYP24A1, VDR, CYP2R1 MAPT 4228/4885CYP2C9 1626/4885TSHR 256/4885
US-20020091109-A1 Vitamin D3 derivative and treating agent for inflammatory respiratory disease using same CYP24A1, VDR, CYP2R1 MAPT 4228/4885CYP2C9 1626/4885TSHR 256/4885

“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.