SCHEMBL5010306

SCHEMBL5010306

O=S(=O)(c1ccc(Cl)cc1)c1ncc2ccn(-c3ccccc3)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.46
MAPK1 P28482 2/20 0.46
CDC7 O00311 1/20 0.46
CHEK1 O14757 1/20 0.46
AURKA O14965 1/20 0.46
DCLK1 O15075 1/20 0.46
MAPK13 O15264 1/20 0.46
PDPK1 O15530 1/20 0.46
DAPK3 O43293 1/20 0.46
ROCK2 O75116 1/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
PAK4 O96013 1/20 0.46
CHEK2 O96017 1/20 0.46
EGFR P00533 1/20 0.46
ERBB2 P04626 1/20 0.46
NTRK1 P04629 1/20 0.46
PRKCG P05129 1/20 0.46
INSR P06213 1/20 0.46
LCK P06239 1/20 0.46

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
SCHEMBL29650985 0.73 JAK2 (0.44) JAK2MAPK1CDC7CHEK1AURKA
SCHEMBL11916210 0.73 JAK2 (0.44) JAK2MAPK1CDC7CHEK1AURKA
SCHEMBL28316674 0.70 CYP19A1 (0.49) JAK2AURKADAPK3PAK4NTRK1
SCHEMBL3401229 0.69 JAK2 (0.45) JAK2AURKAPTGS2
SCHEMBL10979304 0.68 ALDH1A1 (0.60) MAPK1HTTSMN1; SMN2PKMKDM4E
SCHEMBL26270373 0.68 MAPKAPK2 (0.56) JAK2MAPK1CDC7CHEK1AURKA
SCHEMBL10979591 0.66 HTR6 (0.50) MAPK1AURKAHTTSMN1; SMN2NPSR1
SCHEMBL17464105 0.66 SRC (0.39) JAK2MAPK1CDC7CHEK1AURKA
SCHEMBL1657463 0.65 JAK2 (0.65) JAK2MAPK1CDC7CHEK1AURKA
SCHEMBL9625903 0.65 KMT2A (0.43) HTTSMN1; SMN2NPSR1LMNAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465726-B2 Substituted pyrrolo[2.3-B]pyridines OSI PHARMACEUTICALS, INC. (US) 2008-12-16 US disclosed
CN-101052629-A Aryl-amino substituted pyrrolopyrimidine multi-kinase inhibiting compounds OSI PHARM INC (US) 2007-10-10 CN disclosed
US-20060211678-A1 Aryl-amino substituted pyrrolopyrimidine multi-kinase inhibiting compounds OSI PHARMACEUTICALS, INC. 2006-09-21 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 (1 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-20060211678-A1 Aryl-amino substituted pyrrolopyrimidine multi-kinase inhibiting compounds BMX, ERBB2, FRK JAK2 49/4885MAPK1 343/4885CDC7 688/4885

“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.