SCHEMBL5533042

SCHEMBL5533042

CN(C)c1ccc(C(=O)C(Cl)c2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.69
▸ KDM4E B2RXH2 1/20 0.69
▸ RAB9A P51151 4/20 0.56
▸ HPGD P15428 4/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ HDAC3 O15379 1/20 0.50
▸ HDAC4 P56524 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC7 Q8WUI4 1/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ HDAC10 Q969S8 1/20 0.50
▸ HDAC11 Q96DB2 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ HDAC9 Q9UKV0 1/20 0.50
▸ HDAC5 Q9UQL6 1/20 0.50
▸ MAPT P10636 4/20 0.48
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ ROCK2 O75116 1/20 0.47

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
SCHEMBL11748687 0.93 ALDH1A1 (0.59) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11754053 0.91 ALDH1A1 (0.56) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11748782 0.85 ALDH1A1 (0.57) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11752709 0.85 ALDH1A1 (0.57) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11752785 0.83 ALDH1A1 (0.52) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL458300 0.82 TDP1 (0.61) ALDH1A1RAB9AHPGDNPC1KMT2A
SCHEMBL67861 0.81 ALDH1A1 (1.00) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11750443 0.81 LMNA (0.55) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL11748817 0.80 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL10948973 0.79 CES2 (0.53) KDM4EMAPTKMT2AMEN1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7229842-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2007-06-12 — — US disclosed
US-7229842-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2007-06-12 — — US disclosed
US-7229842-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2007-06-12 — — US disclosed
US-20050214875-A1 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG, INC. 2005-09-29 — — US disclosed
US-6916667-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2005-07-12 — — US disclosed
US-20040121490-A1 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG INC. 2004-06-24 — — US disclosed
US-6692975-B2 COMPOUNDS FOR USE IN THE DETECTION OF PREFERENTIAL PARTICLES IN SAMPLE DADE BEHRING MARBURG GMBH (DE) 2004-02-17 — — US disclosed
US-20020058280-A1 Metal chelate containing compositions for use in chemiluminescent assays SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2002-05-16 — — US disclosed
US-6340599-B1 TERBIUM, DYSPROSIUM, SAMARIUM, OSMIUM, OR RUTHENIUM COMPLEX WITH UNSATURATED OXYARYL COMPOUND DADE BEHRING MARBURG GMBH (DE) 2002-01-22 — — US disclosed
EP-1091211-A1 Metal chelate containing compositions for use in chemiluminescent assays Dade Behring Marburg GmbH (DE) 2001-04-11 — — EP disclosed
US-5811311-A CONTAINING LATEX WITH SPECIFIC BINDING PAIR INCORPORATED THEREIN DADE BEHRING MARBURG GMBH (DE) 1998-09-22 — — US disclosed
US-5780646-A CHEMILUMINESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS BEHRINGWERKE AG (DE) 1998-07-14 — — US disclosed
US-5578498-A FOR DETERMINING AN ANALYTE IN A SAMPLE BEHRINGWERKE AG (DE) 1996-11-26 — — US disclosed
EP-0730738-A1 METAL CHELATE CONTAINING COMPOSITIONS FOR USE IN CHEMILUMINESCENT ASSAYS BEHRINGWERKE AG (DE) 1996-09-11 — — EP disclosed
US-5536834-A CHEMILUMINESCENCE COMPOUNDS FOR MEDICAL DIAGNOSIS BEHRINGWERKE AG (DE) 1996-07-16 — — US disclosed
WO-1995014928-A1 METAL CHELATE CONTAINING COMPOSITIONS FOR USE IN CHEMILUMINESCENT ASSAYS BEHRINGWERKE AG (DE) 1995-06-01 — — WO disclosed
US-4275200-A CONDENSATION OF CARBAMIC ESTERS WITH X-HALOGEN CARBONYL COMPOUNDS AGFA-GEVAERT, A.G. (DE) 1981-06-23 — — US disclosed
US-4059447-A Photographic material containing oxazolinone-2 couplers AGFA-GEVAERT AKTIENGESELLSCHAFT (DT) 1977-11-22 — — US disclosed
US-4051250-A OXAZOLE, THIAZOLE MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-09-27 — — US disclosed
US-3933840-A ANTIPHLOGISTIC MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-01-20 — — 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 (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-20040121490-A1 Metal chelate containing compositions for use in chemiluminescent assays AOC1, LPO, SMOX ALDH1A1 1473/4885KDM4E 4167/4885RAB9A 3675/4885
US-20050214875-A1 Metal chelate containing compositions for use in chemiluminescent assays AOC1, LPO, SMOX ALDH1A1 1473/4885KDM4E 4167/4885RAB9A 3675/4885

“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.

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