SCHEMBL437963

SCHEMBL437963

CCC[SiH](C)C1CCCCC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.36
SHBG P04278 1/20 0.32
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 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
SCHEMBL28095742 0.86 CYP1A2 (0.48) CYP1A2SHBGNOS1NOS2
SCHEMBL2734204 0.79 SHBG (0.35) CYP1A2SHBG
SCHEMBL15914614 0.77 CYP1A2 (0.37) CYP1A2SHBGNOS3NOS1NOS2
SCHEMBL15914307 0.77 CYP1A2 (0.37) CYP1A2SHBGNOS3NOS1NOS2
SCHEMBL29012920 0.74 CPN1 (0.31)
SCHEMBL15915178 0.74 CYP1A2 (0.33) CYP1A2
SCHEMBL15914519 0.74 CYP1A2 (0.33) CYP1A2
SCHEMBL28191679 0.72 SIGMAR1 (0.34)
SCHEMBL15916141 0.71 CYP1A2 (0.33) CYP1A2SHBG
SCHEMBL16707886 0.70

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2023-11-02 US disclosed
US-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2023-09-21 US disclosed
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES PURDUE RESEARCH FOUNDATION 2017-09-21 US disclosed
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2017-09-14 US disclosed
US-20170151340-A1 Conjugates Containing Hydrophilic Spacer Linkers ENDOCYTE INC (US) 2017-06-01 US disclosed
US-9662402-B2 Drug delivery conjugates containing unnatural amino acids and methods for using ENDOCYTE, INC. (US) 2017-05-30 US disclosed
US-9636413-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-05-02 US disclosed
US-9555139-B2 Binding ligand linked drug delivery conjugates of tubulysins ENDOCYTE, INC. (US) 2017-01-31 US disclosed
US-9555139-B2 Binding ligand linked drug delivery conjugates of tubulysins ENDOCYTE, INC. (US) 2017-01-31 US disclosed
US-20160361433-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2016-12-15 US disclosed
US-8105568-B2 Vitamin receptor binding drug delivery conjugates ENDOCYTE, INC. (US) 2012-01-31 US disclosed
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES PURDUE RESEARCH FOUNDATION (US) 2012-01-26 US disclosed
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2011-11-24 US disclosed
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS ENDOCTYE, INC. 2010-12-23 US disclosed
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2010-12-23 US disclosed
US-20100048490-A1 BINDING LIGAND LINKED DRUG DELIVERY CONJUGATES OF TUBULYSINS ENDOCYTE, INC. 2010-02-25 US disclosed
US-20100004276-A1 VITAMIN RECEPTOR BINDING DRUG DELIVERY CONJUGATES VLAHOV IONTCHO R 2010-01-07 US disclosed
US-7601332-B2 Minimized toxicity; eliminating pathogenic cell populations; synthesis; claimed intermediates ENDOCYTE, INC. (US) 2009-10-13 US disclosed
US-20080280937-A1 Ligand Conjugates of Vinca Alkaloids, Analogs, and Derivatives ENDOCYTE, INC. 2008-11-13 US disclosed
US-20080248052-A1 Vitamin receptor binding drug delivery conjugate ENDOCYTE, INC. 2008-10-09 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 (14 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-20230293497-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 CYP1A2 4799/4885SHBG 9/4885NOS3 4869/4885
US-20120022245-A1 FOLATE TARGETING OF NUCLEOTIDES FOLR1, FOLR2, DHFR CYP1A2 4475/4885SHBG 4141/4885NOS3 2553/4885
US-20100004276-A1 VITAMIN RECEPTOR BINDING DRUG DELIVERY CONJUGATES VDR, CYP2R1, CYP24A1 CYP1A2 1392/4885SHBG 296/4885NOS3 4815/4885
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 CYP1A2 4850/4885SHBG 24/4885NOS3 4856/4885
US-20080248052-A1 Vitamin receptor binding drug delivery conjugate VDR, HCAR1, FOLR1 CYP1A2 2112/4885SHBG 298/4885NOS3 4876/4885
US-20170266303-A1 METHODS OF TREATING CANCER BY TARGETING TUMOR-ASSOCIATED MACROPHAGES FOLR1, FOLR2, FOLH1 CYP1A2 2973/4885SHBG 2068/4885NOS3 3516/4885
US-20170151340-A1 Conjugates Containing Hydrophilic Spacer Linkers CD44, HAVCR2, HCAR1 CYP1A2 4614/4885SHBG 1143/4885NOS3 4860/4885
US-20080280937-A1 Ligand Conjugates of Vinca Alkaloids, Analogs, and Derivatives VDR, HCAR1, FOLR1 CYP1A2 1292/4885SHBG 338/4885NOS3 4815/4885
US-20160361433-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 CYP1A2 4453/4885SHBG 194/4885NOS3 4113/4885
US-20170258932-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 CYP1A2 4453/4885SHBG 194/4885NOS3 4113/4885
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 CYP1A2 4799/4885SHBG 9/4885NOS3 4869/4885
US-20100048490-A1 BINDING LIGAND LINKED DRUG DELIVERY CONJUGATES OF TUBULYSINS TEK, TEKT1, VDR CYP1A2 4857/4885SHBG 489/4885NOS3 4870/4885
US-20100323973-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS CD44, HAVCR2, HCAR1 CYP1A2 4614/4885SHBG 1143/4885NOS3 4860/4885
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 CYP1A2 4799/4885SHBG 9/4885NOS3 4869/4885

“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.