SCHEMBL4236358

SCHEMBL4236358

NC(=O)C(I)c1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.41
▸ HPGD P15428 5/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MAPT P10636 1/20 0.41
▸ GUSB P08236 2/20 0.40
▸ CYP1A2 P05177 5/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ GLA P06280 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP3A4 P08684 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ERBB2 P04626 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ ACHE P22303 1/20 0.37

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
SCHEMBL27913426 0.80 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL8623920 0.80 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL1801990 0.80 ALDH1A1 (0.45) ALDH1A1HPGDKDM4EMAPTCYP1A2
SCHEMBL15389969 0.77 ALDH1A1 (0.51) ALDH1A1HPGDKDM4ECYP1A2LMNA
SCHEMBL7111827 0.73 KMT2A (0.50) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL6583480 0.72 ALDH1A1 (0.48) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL28304704 0.72 ALDH1A1 (0.48) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL12722762 0.72 ALDH1A1 (0.48) ALDH1A1HPGDKDM4EMAPTGUSB
SCHEMBL19034219 0.71 ALDH1A1 (0.50) ALDH1A1HPGDKDM4EMAPTCYP1A2
SCHEMBL500318 0.71 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EMAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014106122-A1 COMPOSITIONS AND METHODS FOR BIO-BUTADIENE PRODUCTION SCREENING GENOMATICA, INC. (US) 2014-07-03 — — WO claimed
US-20150238466-A1 LIM KINASE INHIBITORS RAMOT AT TEL-AVIV UNIVERSITY LTD. (IL) 2015-08-27 — — US disclosed
EP-2867201-A1 LIM KINASE INHIBITORS Ramot at Tel-Aviv University Ltd. (IL) 2015-05-06 — — EP disclosed
WO-2014106122-A1 COMPOSITIONS AND METHODS FOR BIO-BUTADIENE PRODUCTION SCREENING GENOMATICA, INC. (US) 2014-07-03 — — WO disclosed
WO-2014002101-A1 LIM KINASE INHIBITORS RAMOT AT TEL-AVIV UNIVERSITY LTD (IL) 2014-01-03 — — WO disclosed
WO-2009124226-A2 GELSOLIN USES IN NEUROLOGICAL DISORDERS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2009-10-08 — — WO disclosed
US-7282571-B2 Methods for stabilizing proteins CYTOSKELETON INC. (US) 2007-10-16 — — US disclosed
US-20050171341-A1 Concentrating a pyrene actin; mixing the concentrated pyrene actin with sucrose, a stabilizing agent, and a reducing agent, rapidly freezing DAVIS ASHLEY S (US) 2005-08-04 — — US disclosed
US-20050084853-A1 Aspergillus fumigatus profilin NISLOW COREY (US) 2005-04-21 — — US disclosed
US-6780987-B1 NUCLEIC ACIDS MOLECULES, DESIGNATED BETA CAP73 NUCLEIC ACID MOLECULES, WHICH ENCODE A NOVEL ACTIN BINDING PROTEIN; DIAGNOSTIC AND THERAPEUTIC METHODS UTILIZING COMPOSITIONS OF THE PROTEINS TRUSTEES OF THE TUFTS COLLEGE 2004-08-24 — — US disclosed
US-6403372-B1 Aspergillus fumigatus profilin CYTOKINETICS, INC. 2002-06-11 — — US disclosed
WO-2002042467-A2 ASPERGILLUS FUMIGATUS PROFILIN CYTOKINETICS (US) 2002-05-30 — — WO disclosed
WO-2002042451-A2 ASPERGILLUS FUMIGATUS COFILIN CYTOKINETICS (US) 2002-05-30 — — WO disclosed
EP-0655089-B1 EFFECTS OF ACTIN FILAMENTS ON FIBRIN CLOT STRUCTURE AND LYSIS BRIGHAM & WOMENS HOSPITAL (US) 2000-11-08 — — EP disclosed
US-5691160-A Effects of actin filaments of fibrin clot structure and lysis BIOGEN, INC. (US) 1997-11-25 — — US disclosed
EP-0655089-A4 EFFECTS OF ACTIN FILAMENTS ON FIBRIN CLOT STRUCTURE AND LYSIS. BRIGHAM & WOMENS HOSPITAL (US) 1997-04-02 — — EP disclosed
EP-0655089-A1 EFFECTS OF ACTIN FILAMENTS ON FIBRIN CLOT STRUCTURE AND LYSIS BRIGHAM AND WOMEN'S HOSPITAL (US) 1995-05-31 — — EP disclosed
WO-1994004704-A1 EFFECTS OF ACTIN FILAMENTS ON FIBRIN CLOT STRUCTURE AND LYSIS BRIGHAM AND WOMEN'S HOSPITAL (US) 1994-03-03 — — WO disclosed
WO-1993025564-A1 PHOSPHOINOSITIDE-BINDING PEPTIDES DERIVED FROM THE SEQUENCES OF GELSOLIN AND VILLIN BRIGHAM AND WOMEN'S HOSPITAL (US) 1993-12-23 — — WO disclosed
US-4537718-A GLUTATHIONE JOINED BY LINKAGE GROUPS TO A SECTROSCOPIC REPORTER COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 1985-08-27 — — 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 (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-20150238466-A1 LIM KINASE INHIBITORS LIMK1, LIMK2, LIMA1 ALDH1A1 4701/4885HPGD 3640/4885KDM4E 1739/4885

“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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