SCHEMBL93903

SCHEMBL93903

CCCCCCCCCCCCC#CC#CCCCCCCCCCBr

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 7/20 0.53
PTPN7 P35236 4/20 0.53
SELP P16109 1/20 0.43
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TSHR P16473 1/20 0.38
THRB P10828 1/20 0.38
KCNH2 Q12809 1/20 0.36

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
SCHEMBL17965807 0.95 HMGCR (0.53) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL15283638 0.95 HMGCR (0.53) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL15286305 0.91 HMGCR (0.44) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL28587196 0.90 PTPN7 (0.50) HMGCRPTPN7RECQLTDP1TSHR
SCHEMBL3123632 0.90 PTPN7 (0.50) HMGCRPTPN7RECQLTDP1TSHR
SCHEMBL11654013 0.90 PTPN7 (0.50) HMGCRPTPN7RECQLTDP1TSHR
SCHEMBL3426230 0.87 HMGCR (0.64) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL2555532 0.87 HMGCR (0.64) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL9743665 0.87 HMGCR (0.64) HMGCRPTPN7SELPRECQLTDP1
SCHEMBL5184571 0.87 HMGCR (0.64) HMGCRPTPN7SELPRECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9163307-B2 Three-dimensional photoresists via functionalization of polymer thin films fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-20 US claimed
US-20130260054-A1 Three-Dimensional Photoresists via Functionalization of Polymer Thin Films Fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 US claimed
WO-2013148126-A1 THREE-DIMENSIONAL PHOTORESISTS VIA FUNCTIONALIZATION OF POLYMER THIN FILMS FABRICATED BY ICVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 WO claimed
US-9839700-B2 Polymerized micelles for diagnosis COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2017-12-12 US disclosed
US-9163307-B2 Three-dimensional photoresists via functionalization of polymer thin films fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-10-20 US disclosed
US-20130260054-A1 Three-Dimensional Photoresists via Functionalization of Polymer Thin Films Fabricated by iCVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 US disclosed
WO-2013148126-A1 THREE-DIMENSIONAL PHOTORESISTS VIA FUNCTIONALIZATION OF POLYMER THIN FILMS FABRICATED BY ICVD MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-10-03 WO disclosed
US-20130230467-A1 POLYMERIZED MICELLES FOR DIAGNOSIS COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2013-09-05 US disclosed
EP-2425817-A1 Polymerized micelles for diagnosis Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2012-03-07 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-20130230467-A1 POLYMERIZED MICELLES FOR DIAGNOSIS MCTS1, VHL, PBRM1 HMGCR 767/4885PTPN7 4401/4885SELP 822/4885

“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.