SCHEMBL4996647

SCHEMBL4996647

NC(=O)c1ccc(-c2cnns2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 10/20 0.50
MKNK2 Q9HBH9 10/20 0.50
NNMT P40261 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAP4K4 O95819 2/20 0.42
CHEK2 O96017 3/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CHEK1 O14757 2/20 0.40
CYP17A1 P05093 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
GFER P55789 1/20 0.40
RUNX1 Q01196 1/20 0.40

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
SCHEMBL9133011 0.84 CSNK2A1 (0.51) MKNK1MKNK2ALDH1A1GAAMAPT
SCHEMBL2659243 0.76 ALDH1A1 (0.45) MKNK1MKNK2CHEK2CHEK1ALDH1A1
SCHEMBL16718767 0.76 ALDH1A1 (0.45) MKNK1MKNK2NNMTSMN1; SMN2CHEK2
SCHEMBL224905 0.75 APP (0.48) SMN1; SMN2MAP4K4ALDH1A1GAAMAPT
SCHEMBL7378061 0.74 ALDH1A1 (0.34) ALDH1A1GAAMAPTHPGDHTT
SCHEMBL7379774 0.73 FFAR2 (0.35) ALDH1A1GAAMAPTHPGDHTT
SCHEMBL31173737 0.73 CHEK2 (0.67) MKNK1MKNK2NNMTSMN1; SMN2MAP4K4
SCHEMBL28205638 0.73 MKNK1 (0.49) MKNK1MKNK2NNMTSMN1; SMN2MAP4K4
SCHEMBL7381518 0.72 ALDH1A1 (0.33) ALDH1A1GAAMAPTHPGDHTT
SCHEMBL7381515 0.72 ALDH1A1 (0.33) ALDH1A1GAAMAPTHPGDHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050182050-A1 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2005-08-18 US claimed
US-6812225-B2 PYSCHOLOGICAL DISORDERS; ANTIDEPRESSANTS ASTRAZENECA AB (SE) 2004-11-02 US claimed
US-20030013708-A1 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2003-01-16 US claimed
WO-2020183011-A1 HTR1D INHIBITORS AND USES THEREOF IN THE TREATMENT OF CANCER INSTITUT CURIE (FR) 2020-09-17 WO disclosed
US-20080076759-A1 Therapeutic Heterocyclic Compounds 507 ASTRAZENECA AB (SE) 2008-03-27 US disclosed
US-7285662-B2 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2007-10-23 US disclosed
US-20060178372-A1 Therapeutic quinoline compounds ASTRAZENECA AB (SE) 2006-08-10 US disclosed
US-7045514-B2 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2006-05-16 US disclosed
US-7026314-B2 Psychological disorders, antidepressants, anxiolytic agents, eating disorders; serotonin receptors antagonist ASTRAZENECA AB (SE) 2006-04-11 US disclosed
US-20060019947-A1 Therapeutic chromone compounds CHAPDELAINE MARC 2006-01-26 US disclosed
US-20050182050-A1 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2005-08-18 US disclosed
US-20040087575-A1 Therapeutic chromone compounds SPORT COURT INTERNATIONAL, INC. 2004-05-06 US disclosed
US-20040082591-A1 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2004-04-29 US disclosed
EP-1353914-A2 THERAPEUTIC CHROMONE COMPOUNDS AstraZeneca AB (SE) 2003-10-22 EP disclosed
EP-1353913-A2 THERAPEUTIC HETEROCYCLIC COMPOUNDS AstraZeneca AB (SE) 2003-10-22 EP disclosed
EP-1353915-A2 THERAPEUTIC CHROMAN COMPOUNDS AstraZeneca AB (SE) 2003-10-22 EP disclosed
US-20030013708-A1 Therapeutic heterocyclic compounds ASTRAZENECA AB (SE) 2003-01-16 US disclosed
WO-2002055012-A2 THERAPEUTIC HETEROCYCLIC COMPOUNDS ASTRAZENECA AB (SE) 2002-07-18 WO disclosed
WO-2002055013-A2 THERAPEUTIC CHROMONE COMPOUNDS ASTRAZENECA AB (SE) 2002-07-18 WO disclosed
WO-2002055014-A2 THERAPEUTIC CHROMAN COMPOUNDS ASTRAZENECA AB (SE) 2002-07-18 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 (7 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-20080076759-A1 Therapeutic Heterocyclic Compounds 507 HTR1A, HTR1B, HTR1D MKNK1 3171/4885MKNK2 3239/4885NNMT 2332/4885
US-20060178372-A1 Therapeutic quinoline compounds HTR1B, HTR3B, HTR1A MKNK1 3347/4885MKNK2 3068/4885NNMT 1647/4885
US-20040087575-A1 Therapeutic chromone compounds HTR1B, HTR1A, HTR3B MKNK1 2228/4885MKNK2 2192/4885NNMT 3258/4885
US-20050182050-A1 Therapeutic heterocyclic compounds HTR1B, HTR1D, HTR1A MKNK1 3241/4885MKNK2 3371/4885NNMT 2351/4885
US-20030013708-A1 Therapeutic heterocyclic compounds HTR1A, HTR1D, HTR1B MKNK1 3116/4885MKNK2 3501/4885NNMT 2332/4885
US-20040082591-A1 Therapeutic heterocyclic compounds HTR1A, HTR1D, HTR1B MKNK1 3239/4885MKNK2 3611/4885NNMT 2193/4885
US-20060019947-A1 Therapeutic chromone compounds HTR1B, HTR3B, HTR1A MKNK1 2273/4885MKNK2 2021/4885NNMT 3191/4885

“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.