SCHEMBL2956501

SCHEMBL2956501

NC(=O)c1sc2c(ccc(=O)n2-c2ccccc2)c1Nc1cccc(Cl)n1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
MAT2A P31153 3/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 3/20 0.34
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
AGTR1 P30556 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.32
JAK2 O60674 2/20 0.32
JUN P05412 1/20 0.32
LIMK1 P53667 1/20 0.31

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
SCHEMBL2956177 0.88 JAK2 (0.44) ALDH1A1SMN1; SMN2LMNAMAPTKDM4E
SCHEMBL2956528 0.84 RORC (0.36) ALDH1A1LMNAMAPTKDM4EHPGD
SCHEMBL2958575 0.82 CDK4 (0.38) ALDH1A1SMN1; SMN2MAPTKDM4EGAA
SCHEMBL2958686 0.81 CXCL8 (0.36) ALDH1A1SMN1; SMN2LMNAMAPTKDM4E
SCHEMBL2952784 0.81 NPC1 (0.41) ALDH1A1LMNAMAPTKDM4EGAA
SCHEMBL2956202 0.81 SMN1; SMN2 (0.36) ALDH1A1SMN1; SMN2LMNAMAT2AGAA
SCHEMBL2958025 0.81 DHODH (0.37) ALDH1A1MAT2AMAPTKDM4EKMT2A
SCHEMBL2958045 0.80 CXCR2 (0.39) ALDH1A1SMN1; SMN2LMNAMAPTKDM4E
SCHEMBL2955772 0.78 CYP3A4 (0.39) ALDH1A1LMNAMAPTKDM4EKMT2A
SCHEMBL2955899 0.77 CSF1R (0.39) ALDH1A1SMN1; SMN2LMNAMAPTGAA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7763729-B2 Bicyclic heteroaromatic derivatives UCB PHARMA S.A. (BE) 2010-07-27 US claimed
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives CELLTECH R&D LIMITED (GB) 2009-02-12 US claimed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US claimed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 US claimed
US-7763729-B2 Bicyclic heteroaromatic derivatives UCB PHARMA S.A. (BE) 2010-07-27 US disclosed
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives CELLTECH R&D LIMITED (GB) 2009-02-12 US disclosed
US-7423047-B2 Arylamine substituted bicyclic heteroaromatic compounds as p38 kinase inhibitors CELLTECH R&D LIMITED (GB) 2008-09-09 US disclosed
US-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors UCB PHARMA S.A. (BE) 2006-01-05 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-20060004025-A1 Arylamine substututed bicyclic heteroaromatic compounds as p38 kinase inhibitors MAPK1, CNKSR1, ALK ALDH1A1 1045/4885SMN1; SMN2 3637/4885LMNA 3193/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 ALDH1A1 717/4885SMN1; SMN2 3472/4885LMNA 3052/4885

“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.