SCHEMBL1064767

SCHEMBL1064767

O=C(O)CC[C@H](NC(=O)c1ccc(N(CCCl)CCCl)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.56
CA1 P00915 3/20 0.56
CA12 O43570 1/20 0.55
CA9 Q16790 1/20 0.55
LMNA P02545 3/20 0.52
FOLH1 Q04609 2/20 0.52
DHFR P00374 4/20 0.49
EGFR P00533 1/20 0.49
ERBB2 P04626 1/20 0.49
GMNN O75496 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP2D6 P10635 1/20 0.49
MAPT P10636 1/20 0.49
GABRA1 P14867 1/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
THPO P40225 1/20 0.49
GABRA2 P47869 1/20 0.49
GABRB2 P47870 1/20 0.49
PMP22 Q01453 1/20 0.49

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
SCHEMBL9014687 1.00 CA2 (0.56) CA2CA1CA12CA9LMNA
SCHEMBL14497757 0.87 CA2 (0.52) CA2CA1CA12CA9LMNA
SCHEMBL887827 0.87 CA2 (0.52) CA2CA1CA12CA9LMNA
SCHEMBL13338129 0.87 CA2 (0.52) CA2CA1CA12CA9LMNA
SCHEMBL8726202 0.84 CA2 (0.46) CA2CA1CA12CA9LMNA
SCHEMBL7902186 0.84 FOLH1 (0.58) LMNAFOLH1GMNNALDH1A1CYP2D6
SCHEMBL4458797 0.84 FOLH1 (0.58) LMNAFOLH1GMNNALDH1A1CYP2D6
SCHEMBL27564186 0.83 CA2 (0.75) CA2CA1CA12CA9LMNA
Hydrochloric Acid SCHEMBL7903946 0.82 FOLH1 (0.57) LMNAFOLH1GMNNALDH1A1CYP2D6
SCHEMBL7900436 0.82 KMT2A (0.69) LMNAFOLH1GMNNALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43586-E1 Antibodies to prostate-specific membrane antigen SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2012-08-14 US disclosed
CN-102099045-A Attenuated oncolytic paramyxoviruses encoding avian cytokines BAYER SCHERING PHARMA AG 2011-06-15 CN disclosed
EP-2292246-A1 Recombinant Newcastle Disease Virus Bayer Schering Pharma Aktiengesellschaft (DE) 2011-03-09 EP disclosed
EP-0668777-B2 PROSTATE-SPECIFIC MEMBRANE ANTIGEN SLOAN KETTERING INST CANCER (US) 2011-02-09 EP disclosed
US-20110020282-A1 RECOMBINANT NEWCASTLE DISEASE VIRUS BEIER RUDOLF 2011-01-27 US disclosed
US-20100310452-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF SLOAN KETTERING INSTITUTE FOR CANCER RESEARCH 2010-12-09 US disclosed
US-20100303715-A1 Prostate-specific membrane antigen and uses thereof ISRAELI RON S 2010-12-02 US disclosed
CN-101875919-A Recombinant newcastle disease virus BAYER SCHERING PHARMA AG 2010-11-03 CN disclosed
EP-2237790-A1 ATTENUATED ONCOLYTIC PARAMYXOVIRUSES ENCODING AVIAN CYTOKINES Bayer Schering Pharma Aktiengesellschaft (DE) 2010-10-13 EP disclosed
US-20100092430-A1 ATTENUATED ONCOLYTIC PARAMYXOVIRUSES ENCODING AVIAN CYTOKINES BAYER SCHERING PHARMA AG (DE) 2010-04-15 US disclosed
WO-1996026272-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1996-08-29 WO disclosed
US-5538866-A IMMUNOASSAY; MEDICAL DIAGNOSIS SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1996-07-23 US disclosed
EP-0696270-A1 4-AMINO-FLUOROBENZAMIDES AND THEIR USE AS CYTOTOXIC PRODRUGS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1996-02-14 EP disclosed
EP-0668777-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN Sloan-Kettering Institute For Cancer Research (US) 1995-08-30 EP disclosed
WO-1994025429-A1 4-AMINO-FLUOROBENZAMIDES AND THEIR USE AS CYTOTOXIC PRODRUGS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-11-10 WO disclosed
US-5359120-A Reacting nitrogen mustard compounds with amino acid or oligopeptide compounds CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1994-10-25 US disclosed
WO-1994009820-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1994-05-11 WO disclosed
EP-0433360-B1 IMPROVEMENTS RELATING TO THE PRODUCTION OF PRODRUGS CANCER RES CAMPAIGN TECH (GB) 1994-03-23 EP disclosed
EP-0433360-A1 IMPROVEMENTS RELATING TO THE PRODUCTION OF PRODRUGS. CANCER RES CAMPAIGN TECH (GB) 1991-06-26 EP disclosed
WO-1990002729-A1 IMPROVEMENTS RELATING TO THE PRODUCTION OF PRODRUGS CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) 1990-03-22 WO 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-20100310452-A1 PROSTATE-SPECIFIC MEMBRANE ANTIGEN AND USES THEREOF KLK3, ACP3, FOLH1 CA2 1265/4885CA1 462/4885CA12 39/4885

“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.