SCHEMBL2960764

SCHEMBL2960764

N#Cc1ccccc1Nc1c(C(N)=O)sc2c1ccc(=O)n2-c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.38
TTK P33981 2/20 0.35
THRB P10828 2/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 1/20 0.33
PTK2 Q05397 1/20 0.32
SMO Q99835 1/20 0.32
ACHE P22303 1/20 0.32
MAPT P10636 2/20 0.32
HTT P42858 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MAPK1 P28482 1/20 0.32
CXCR2 P25025 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
USP2 O75604 1/20 0.31
RAB9A P51151 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
SCHEMBL2954063 0.92 USP2 (0.37) LMNATHRBTDP1TP53ACHE
SCHEMBL2960720 0.87 ALDH1A1 (0.39) LMNAPOLBACHEMAPTALDH1A1
SCHEMBL4579752 0.87 LMNA (0.32) LMNATHRBTP53ALDH1A1MAPK1
SCHEMBL2952402 0.86 THRB (0.33) LMNATHRBTP53HTTALDH1A1
SCHEMBL2952671 0.85 KDM4E (0.36) LMNAPOLBMAPTHTTALDH1A1
SCHEMBL2958842 0.83 MAP3K11 (0.36) THRB
SCHEMBL1265882 0.83 USP2 (0.37) LMNATHRBTDP1TP53ACHE
Lithium Ion SCHEMBL1265878 0.82 USP2 (0.36) LMNATHRBTDP1TP53ACHE
SCHEMBL2957997 0.81 GRM2 (0.37) TDP1TP53MAPTALDH1A1HPGD
SCHEMBL2955899 0.81 CSF1R (0.39) LMNAPOLBTDP1TP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 LMNA 3193/4885TTK 332/4885THRB 749/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 LMNA 3052/4885TTK 623/4885THRB 1114/4885

“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.