SCHEMBL2960348

SCHEMBL2960348

Cc1ccc(-n2c(=O)ccc3c(Nc4ccc(F)c(C)c4)c(C#N)sc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.34
GFER P55789 1/20 0.34
IDO1 P14902 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RAPGEF4 Q8WZA2 2/20 0.33
CRHBP P24387 1/20 0.33
MAPK1 P28482 1/20 0.33
CRHR2 Q13324 1/20 0.33
KDM4E B2RXH2 2/20 0.32
ESR1 P03372 1/20 0.32
HPGD P15428 1/20 0.32
ESR2 Q92731 1/20 0.32
TDO2 P48775 1/20 0.31
CSF1R P07333 1/20 0.31
CDK4 P11802 1/20 0.30
CDK2 P24941 1/20 0.30

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
SCHEMBL2954154 0.92 LMNA (0.36) LMNAGAAGFERALDH1A1RAPGEF4
SCHEMBL2950115 0.85 LMNA (0.35) LMNAGAAGFERALDH1A1RAPGEF4
SCHEMBL2947088 0.85 IDO1 (0.39) LMNAGAAIDO1ALDH1A1CRHBP
SCHEMBL2952952 0.83 CHRNA7 (0.35) LMNAGAAGFERIDO1RAPGEF4
SCHEMBL2959756 0.82 IDO1 (0.37) IDO1ALDH1A1KDM4EHPGD
SCHEMBL2950317 0.82 CSF1R (0.39) GAAIDO1ALDH1A1RAPGEF4HPGD
SCHEMBL2952695 0.80 LMNA (0.36) LMNAGAAGFERALDH1A1RAPGEF4
SCHEMBL2950043 0.80 MAP3K8 (0.41) IDO1TDO2
SCHEMBL2958519 0.80 LMNA (0.34) LMNAGAAGFERIDO1TDO2
SCHEMBL2958784 0.79 IDO1 (0.39) LMNAGAAIDO1ALDH1A1MAPK1

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 4 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 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 3193/4885GAA 4059/4885GFER 1084/4885
US-20090042877-A1 Bicyclic Heteroaromatic Derivatives MAPK1, CNKSR1, CBR1 LMNA 3052/4885GAA 4234/4885GFER 996/4885

“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.