SCHEMBL12145014

SCHEMBL12145014

O=C(O)CCCCP(=O)(O)CCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
GRM8 O00222 1/20 0.52
GRM6 O15303 1/20 0.52
GRM7 Q14831 1/20 0.52
GRM4 Q14833 1/20 0.52
NFKB1 P19838 2/20 0.50
TSHR P16473 1/20 0.50
PMP22 Q01453 1/20 0.50
SLC22A6 Q4U2R8 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
GPR84 Q9NQS5 1/20 0.42
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
AKR1B1 P15121 1/20 0.42
CYP2D6 P10635 1/20 0.42
FOLH1 Q04609 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL2403116 0.87 GRM8 (0.61) LMNAGRM8GRM6GRM7GRM4
SCHEMBL9061995 0.85 GRM8 (0.59) LMNAGRM8GRM6GRM7GRM4
SCHEMBL12145017 0.85 AKR1B1 (0.54) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL338706 0.85 AKR1B1 (0.54) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL339788 0.83 GPR84 (0.56) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL9291138 0.83 GPR84 (0.56) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL9290884 0.83 GPR84 (0.56) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL9290873 0.83 GPR84 (0.56) TSHRSLC22A6GPR84FFAR1FFAR4
SCHEMBL339162 0.82 GABBR2 (0.57) GRM8GRM6GRM7GRM4TSHR
SCHEMBL18096828 0.80 GPR84 (0.52) LMNANFKB1TSHRPMP22SLC22A6

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 16 patents. 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-11717514-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2023-08-08 US disclosed
US-10010618-B2 Methods for treating cancer using combination therapies ENDOCYTE, INC. (US) 2018-07-03 US disclosed
US-20170258923-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2017-09-14 US disclosed
US-20160296630-A1 METHODS FOR TREATING CANCER USING COMBINATION THERAPIES ENDOCYTE INC (US) 2016-10-13 US disclosed
US-20160287731-A1 Compounds for Positron Emission Tomography ENDOCYTE, INC 2016-10-06 US disclosed
US-9415113-B2 Targeting monomers and polymers having targeting blocks UNIVERSITY OF WASHINGTON (US) 2016-08-16 US disclosed
US-20160067341-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION 2016-03-10 US disclosed
US-9193763-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2015-11-24 US disclosed
US-8907058-B2 PSMA binding ligand-linker conjugates and methods for using PURDUE RESEARCH FOUNDATION (US) 2014-12-09 US disclosed
US-20140154702-A1 Methods For Treating Cancer Using Combination Therapies ENDOCYTE INC (US) 2014-06-05 US disclosed
US-20140073763-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2014-03-13 US disclosed
US-20130011362-A1 TARGETING MONOMERS AND POLYMERS HAVING TARGETING BLOCKS PHASERX, INC. (US) 2013-01-10 US disclosed
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2011-11-24 US disclosed
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING PURDUE RESEARCH FOUNDATION (US) 2010-12-23 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 (12 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 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-20130011362-A1 TARGETING MONOMERS AND POLYMERS HAVING TARGETING BLOCKS FOLR1, FOLR2, DHFR LMNA 2061/4885GRM8 758/4885GRM6 559/4885
US-10010618-B2 Methods for treating cancer using combination therapies SLC7A11, CXCR2, TPX2 LMNA 4453/4885GRM8 1008/4885GRM6 1036/4885
US-20110288152-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2258/4885GRM8 569/4885GRM6 991/4885
US-20160296630-A1 METHODS FOR TREATING CANCER USING COMBINATION THERAPIES SLC7A11, CXCR2, TPX2 LMNA 4453/4885GRM8 1008/4885GRM6 1036/4885
US-20170258923-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-20100324008-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-20140073763-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-11717514-B2 PSMA binding ligand-linker conjugates and methods for using FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-20160067341-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885
US-20160287731-A1 Compounds for Positron Emission Tomography FOLH1, FOLR2, FOLR1 LMNA 1873/4885GRM8 1867/4885GRM6 1001/4885
US-20230346752-A1 PSMA BINDING LIGAND-LINKER CONJUGATES AND METHODS FOR USING FOLH1, KLK3, PSMA1 LMNA 2066/4885GRM8 469/4885GRM6 932/4885

“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.