SCHEMBL9972850

SCHEMBL9972850

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nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL11989016 0.84 TSHR (0.33) TSHR
SCHEMBL11989015 0.83 TP53 (0.31)
SCHEMBL14088242 0.83
SCHEMBL20254907 0.82 TSHR (0.40) TSHR
SCHEMBL18651184 0.81
SCHEMBL10019281 0.81
SCHEMBL13235922 0.79
SCHEMBL20920333 0.79
SCHEMBL18651059 0.77 TSHR (0.31) TSHR
SCHEMBL20697436 0.75 MAPT (0.44) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9011918-B2 Biocompatible and biodegradable elastomeric polymers EVONIK CORPORATION (US) 2015-04-21 US disclosed
US-20140187810-A1 STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME ACTELION PHARMACEUTICALS, LTD. (CH) 2014-07-03 US disclosed
US-20130184243-A1 COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF TREATING SKIN DISORDERS THEREWITH CEPTARIS THERAPEUTICS, INC. (US) 2013-07-18 US disclosed
US-20120301518-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS EVONIK OPERATIONS GMBH (DE) 2012-11-29 US disclosed
US-8246991-B2 Biocompatible and biodegradable elastomeric polymers SURMODICS PHARMACEUTICALS, INC. (US) 2012-08-21 US disclosed
US-20120157545-A1 METHODS FOR TREATING SKIN DISORDERS WITH TOPICAL NITROGEN MUSTARD COMPOSITIONS ACTELION PHARMACEUTICALS, LTD. (CH) 2012-06-21 US disclosed
US-20110039943-A1 METHODS FOR TREATING SKIN DISORDERS WITH TOPICAL NITROGEN MUSTARD COMPOSITIONS ACTELION PHARMACEUTICALS, LTD. (CH) 2011-02-17 US disclosed
US-20100003305-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS EVONIK OPERATIONS GMBH (DE) 2010-01-07 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 (6 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-20120301518-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS ECPAS, FN1, DDR1 TSHR 3155/4885
US-20110039943-A1 METHODS FOR TREATING SKIN DISORDERS WITH TOPICAL NITROGEN MUSTARD COMPOSITIONS S100A8, CUTA, S100A4 TSHR 4799/4885
US-20130184243-A1 COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF TREATING SKIN DISORDERS THEREWITH MGMT, UNG, OGG1 TSHR 4712/4885
US-20100003305-A1 BIOCOMPATIBLE AND BIODEGRADABLE ELASTOMERIC POLYMERS ECPAS, FN1, DDR1 TSHR 3155/4885
US-20140187810-A1 STABILIZED COMPOSITIONS OF ALKYLATING AGENTS AND METHODS OF USING SAME MGMT, UNG, ERCC5 TSHR 4791/4885
US-20120157545-A1 METHODS FOR TREATING SKIN DISORDERS WITH TOPICAL NITROGEN MUSTARD COMPOSITIONS S100A8, CUTA, S100A4 TSHR 4799/4885

“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.