SCHEMBL5447282

SCHEMBL5447282

C=C(C)C(=O)OCCCCC1(C(=O)O)CCCCC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
THRB P10828 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL5443893 0.96 TSHR (0.39) TSHRPOLBAPEX1HTTTDP1
SCHEMBL15253486 0.91 THRB (0.36) TSHRPOLBAPEX1HTTTDP1
SCHEMBL36216 0.91 THRB (0.36) TSHRPOLBAPEX1HTTTDP1
SCHEMBL29678494 0.81 TSHR (0.44) TSHRTHRBALDH1A1
SCHEMBL16027798 0.78 THRB (0.31) TSHRTHRBALDH1A1
SCHEMBL28166770 0.78 TSHR (0.41) TSHRTHRBALDH1A1
SCHEMBL28181569 0.77 TSHR (0.50) TSHRPOLBAPEX1HTTTDP1
SCHEMBL5650450 0.76 NAAA (0.39)
SCHEMBL5645678 0.76 NAAA (0.39)
SCHEMBL5644160 0.76 NAAA (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024095925-A1 PHOTOCURABLE COMPOSITION FOR NAILS OR ARTIFICIAL NAILS 株式会社スリーボンド 2024-05-10 WO disclosed
US-20200214956-A1 PHOTOCURABLE COMPOSITION TO BE USED ON FINGERNAILS OR ARTIFICIAL NAILS, BASE COAT AGENT CONTAINING SAME, CURED ARTICLE THEREOF, METHOD FOR PRODUCING CURED ARTICLE THEREOF, METHOD FOR DETACHING CURED ARTICLE THEREOF, METHOD FOR COATING BY USING SAME, AND METHOD FOR USING SAME THREE BOND CO., LTD. (JP) 2020-07-09 US disclosed
US-20190314264-A1 PHOTOCURABLE RESIN COMPOSITION FOR NAIL OR ARTIFICIAL NAIL THREEBOND CO., LTD. (JP) 2019-10-17 US disclosed
US-20180325788-A1 PHOTOCURABLE COMPOSITION TO BE USED ON FINGERNAILS OR ARTIFICIAL NAILS, BASE COAT AGENT CONTAINING SAME, CURED ARTICLE THEREOF, METHOD FOR PRODUCING CURED ARTICLE THEREOF, METHOD FOR DETACHING CURED ARTICLE THEREOF, METHOD FOR COATING BY USING SAME, AND METHOD FOR USING SAME THREE BOND CO., LTD. (JP) 2018-11-15 US disclosed
US-20180325789-A1 PHOTOCURABLE COMPOSITION TO BE USED ON FINGERNAILS OR ARTIFICIAL NAILS, AND METHOD FOR COATING BY USING SAME THREE BOND CO., LTD. (JP) 2018-11-15 US disclosed
US-20070129459-A1 Enamel adhesive composition SUN MEDICAL CO., LTD. (JP) 2007-06-07 US disclosed
EP-1719494-A1 ADHESIVE COMPOSITION FOR ENAMEL SUN MEDICAL CO., LTD. (JP) 2006-11-08 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 (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-20070129459-A1 Enamel adhesive composition COL1A1, H1-0, COL2A1 TSHR 2851/4885POLB 566/4885APEX1 300/4885
US-20200214956-A1 PHOTOCURABLE COMPOSITION TO BE USED ON FINGERNAILS OR ARTIFICIAL NAILS, BASE COAT AGENT CONTAINING SAME, CURED ARTICLE THEREOF, METHOD FOR PRODUCING CURED ARTICLE THEREOF, METHOD FOR DETACHING CURED ARTICLE THEREOF, METHOD FOR COATING BY USING SAME, AND METHOD FOR USING SAME SETD7, SETD2, ACR TSHR 3490/4885POLB 2421/4885APEX1 1196/4885
US-20180325788-A1 PHOTOCURABLE COMPOSITION TO BE USED ON FINGERNAILS OR ARTIFICIAL NAILS, BASE COAT AGENT CONTAINING SAME, CURED ARTICLE THEREOF, METHOD FOR PRODUCING CURED ARTICLE THEREOF, METHOD FOR DETACHING CURED ARTICLE THEREOF, METHOD FOR COATING BY USING SAME, AND METHOD FOR USING SAME SETD7, SETD2, ACR TSHR 3490/4885POLB 2421/4885APEX1 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.