SCHEMBL4632667

SCHEMBL4632667

O=C(Nc1n[nH]c2sc(C(=O)O)cc12)c1cccc(N2CCOCC2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.51
NTRK1 P04629 4/20 0.48
NTRK3 Q16288 1/20 0.48
NTRK2 Q16620 1/20 0.48
AURKA O14965 6/20 0.48
KIT P10721 3/20 0.44
PLOD2 O00469 2/20 0.44
PLOD3 O60568 2/20 0.44
PLOD1 Q02809 2/20 0.44
FLT3 P36888 2/20 0.44
AURKB Q96GD4 2/20 0.43
FGFR1 P11362 2/20 0.43
KDR P35968 2/20 0.43
CDC7 O00311 1/20 0.43
CHEK1 O14757 1/20 0.43
JAK2 O60674 1/20 0.43
PAK4 O96013 1/20 0.43
PRKCB P05771 1/20 0.43
INSR P06213 1/20 0.43
RET P07949 1/20 0.43

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
SCHEMBL2437004 0.90 AURKA (0.55) NTRK1NTRK3NTRK2AURKAKIT
SCHEMBL4632583 0.87 NTRK1 (0.47) KMONTRK1NTRK3NTRK2AURKA
SCHEMBL742820 0.86 AURKA (0.56) KMONTRK1NTRK3NTRK2AURKA
SCHEMBL6374740 0.85 AURKA (0.66) KMONTRK1AURKAKITAURKB
SCHEMBL2413199 0.82 SMN1; SMN2 (0.55) AURKAMAPTHTTRAB9ASMN1; SMN2
SCHEMBL2422128 0.82 MAPT (0.55) AURKAMAPTHTTRAB9ASMN1; SMN2
SCHEMBL4631760 0.82 HDAC10 (0.47) AURKAKITFLT3FGFR1MAPT
SCHEMBL2415468 0.81 SMN1; SMN2 (0.49) AURKAKITFLT3MAPTHTT
SCHEMBL2418496 0.80 MAPT (0.57) AURKAFGFR1MAPTHTTRAB9A
SCHEMBL3089944 0.80 FGFR1 (0.50) AURKAFGFR1JAK2HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1711177-B1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS PFIZER ITALIA SRL (IT) 2008-05-28 EP claimed
EP-1711177-A1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS Pfizer Italia S.r.l. (IT) 2006-10-18 EP claimed
WO-2005074922-A1 1H-THIENO[2,3-c]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS PFIZER ITALIA S.R.L. (IT) 2005-08-18 WO claimed
US-8481584-B2 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2013-07-09 US disclosed
US-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-06-28 US disclosed
EP-1711177-B1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS PFIZER ITALIA SRL (IT) 2008-05-28 EP disclosed
EP-1711177-A1 1H-THIENO 2,3-c PYRAZOLE DERIVATIVES USEFUL AS KINASE I INHIBITORS Pfizer Italia S.r.l. (IT) 2006-10-18 EP disclosed
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2005-08-25 US disclosed
WO-2005074922-A1 1H-THIENO[2,3-c]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS PFIZER ITALIA S.R.L. (IT) 2005-08-18 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-20120165311-A1 1H-THIENO[2,3-C]PYRAZOLE DERIVATIVES USEFUL AS KINASE INHIBITORS MAP3K19, MAP3K1, MAP3K3 KMO 900/4885NTRK1 1360/4885NTRK3 938/4885
US-20050187209-A1 1H-thieno[2,3-c]pyrazole derivatives useful as kinase inhibitors MAP3K19, MAP3K1, MAP3K3 KMO 887/4885NTRK1 1413/4885NTRK3 963/4885

“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.