SCHEMBL2117269

SCHEMBL2117269

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nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 1/20 0.34
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
GALR3 O60755 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL10510831 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10508099 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL570203 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10506976 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10735194 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL570204 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10508209 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL3060848 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10508715 1.00 TSHR (0.41) TSHRTDP1CHRM2CHRM4CHRM1
SCHEMBL10506819 0.94 TSHR (0.42) TSHRTDP1CHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8552176-B2 Glycosylated chlorambucil analogs and uses thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-10-08 US claimed
US-20120094946-A1 GLYCOSYLATED CHLORAMBUCIL ANALOGS AND USES THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-04-19 US claimed
US-20100267655-A1 Glycosylated Warfarin Analogs and Uses Thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-10-21 US claimed
WO-2010014814-A2 GLYCOSYLATED WARFARIN ANALOGS AND USES THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-02-04 WO claimed
US-8552176-B2 Glycosylated chlorambucil analogs and uses thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-10-08 US disclosed
US-8278436-B2 Glycosylated warfarin analogs and uses thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-10-02 US disclosed
US-20120094946-A1 GLYCOSYLATED CHLORAMBUCIL ANALOGS AND USES THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-04-19 US disclosed
US-20100267655-A1 Glycosylated Warfarin Analogs and Uses Thereof WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-10-21 US disclosed
WO-2010014814-A2 GLYCOSYLATED WARFARIN ANALOGS AND USES THEREOF WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-02-04 WO disclosed
EP-0173462-B1 ELLIPTICINE DERIVATIVE AND PRODUCTION PROCESS THEREOF SUNTORY LIMITED (JP) 1989-10-25 EP disclosed
US-4698423-A ANTITUMOR AGENTS SUNTORY LIMITED (JP) 1987-10-06 US disclosed
EP-0173462-A2 Ellipticine derivative and production process thereof SUNTORY LIMITED (JP) 1986-03-05 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 (2 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-20100267655-A1 Glycosylated Warfarin Analogs and Uses Thereof GPI, UGGT1, GALE TSHR 2519/4885TDP1 3781/4885CHRM2 3924/4885
US-20120094946-A1 GLYCOSYLATED CHLORAMBUCIL ANALOGS AND USES THEREOF CD22, UGGT1, UGCG TSHR 1266/4885TDP1 3929/4885CHRM2 3770/4885

“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.