SCHEMBL5659156

SCHEMBL5659156

N#CCc1ccccc1Sc1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IFNAR1 P17181 1/20 0.62
▸ ALDH1A1 P00352 6/20 0.56
▸ LMNA P02545 3/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ NPY1R P25929 1/20 0.56
▸ NPY2R P49146 1/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ RECQL P46063 1/20 0.50
▸ RAD52 P43351 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ NLRP3 Q96P20 1/20 0.44
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ HPGD P15428 4/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ HTT P42858 2/20 0.36

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
SCHEMBL4437147 0.86 ALDH1A1 (0.46) IFNAR1ALDH1A1LMNAMAPK1NPY1R
Hydrochloric Acid SCHEMBL4556353 0.84 ALDH1A1 (0.44) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL30559660 0.80 CYP1A2 (0.52) ALDH1A1LMNAMAPTCYP1A2CYP2C19
SCHEMBL182660 0.80 CYP1A2 (0.52) ALDH1A1LMNAMAPTCYP1A2CYP2C19
SCHEMBL5658941 0.79 IFNAR1 (0.65) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL27869707 0.78 CYP1A2 (0.50) ALDH1A1LMNAMAPTCYP1A2CYP2C19
SCHEMBL31167972 0.78 IFNAR1 (0.60) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL577858 0.78 IFNAR1 (0.60) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL5661131 0.77 IFNAR1 (0.63) IFNAR1ALDH1A1LMNAMAPK1NPY1R
SCHEMBL30996076 0.77 IFNAR1 (1.00) IFNAR1ALDH1A1LMNAMAPK1NPY1R

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-7262309-B2 1- or 3-thia-benzonaphthoazulenes as inhibitors of tumor necrosis factor production and intermediates for the preparation thereof GLAXOSMITH KLINE ISTRAZIVOCKI CENTAR ZAGREB, D.O.O. (HR) 2007-08-28 — — US disclosed
EP-1492795-B1 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF PLIVA ISTRAZIVACKI INST D O O (HR) 2005-11-16 — — EP disclosed
US-20050137249-A1 1-or 3-thia-benznaphthoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof PLIVA-ISTRAZIVACKI INSTITUT D.D.D. (HR) 2005-06-23 — — US disclosed
US-20050130964-A1 1- or 3-thia-benzonaphthoazulenes as inhibitors of tumor necrosis factor production and intermediates for the preparation thereof PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2005-06-16 — — US disclosed
EP-1492795-A1 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF PLIVA-ISTRAZIVACKI INSTITUT d.o.o. (HR) 2005-01-05 — — EP disclosed
WO-2003084961-A1 1- OR 3-THIA-BENZONAPHTHOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARATION THEREOF PLIVA-ISTRAZIVACKI INSTITUT D.O.O. (HR) 2003-10-16 — — 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 (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-20050130964-A1 1- or 3-thia-benzonaphthoazulenes as inhibitors of tumor necrosis factor production and intermediates for the preparation thereof TNF, IL1A, IL1B IFNAR1 430/4885ALDH1A1 86/4885LMNA 3718/4885
US-20050137249-A1 1-or 3-thia-benznaphthoazulenes as inhibitors of tumour necrosis factor production and intermediates for the preparation thereof TNF, IL1A, IL1B IFNAR1 289/4885ALDH1A1 25/4885LMNA 2813/4885

“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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