SCHEMBL1554495

SCHEMBL1554495

CCOC(=O)c1c(-c2cccc(OC)c2)csc1N1C(=O)c2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.52
MAPT P10636 8/20 0.51
ALDH1A1 P00352 6/20 0.51
HPGD P15428 3/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP3A4 P08684 1/20 0.51
LMNA P02545 4/20 0.50
HSD17B10 Q99714 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 3/20 0.47
TP53 P04637 1/20 0.47
PRKCZ Q05513 4/20 0.46
PRKCI P41743 1/20 0.46
KCNH2 Q12809 1/20 0.46
MAPK1 P28482 1/20 0.45
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL1554640 0.89 ALDH1A1 (0.63) PTPN1MAPTALDH1A1HPGDCYP1A2
SCHEMBL1553963 0.89 ALDH1A1 (0.50) MAPTALDH1A1HPGDCYP1A2CYP2C9
SCHEMBL1554259 0.87 ALDH1A1 (0.60) PTPN1MAPTALDH1A1HPGDCYP1A2
SCHEMBL1553328 0.87 ALDH1A1 (0.48) MAPTALDH1A1HPGDCYP1A2CYP2C9
SCHEMBL1553982 0.86 ALDH1A1 (0.52) PTPN1MAPTALDH1A1HPGDLMNA
SCHEMBL4252376 0.84 ALDH1A1 (0.53) PTPN1MAPTALDH1A1HPGDCYP1A2
SCHEMBL1553883 0.84 ALDH1A1 (0.55) MAPTALDH1A1HPGDCYP1A2CYP2C9
SCHEMBL1554657 0.82 ALDH1A1 (0.49) MAPTALDH1A1HPGDCYP1A2CYP2C9
SCHEMBL1554599 0.82 PRKCZ (0.47) PTPN1MAPTALDH1A1HPGDCYP1A2
SCHEMBL4757822 0.82 ALDH1A1 (0.47) MAPTALDH1A1HPGDCYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1383463-B1 FUSED THIOPHENE COMPOUNDS AND USE THEREOF IN THE TREATMENT OF CHRONIC PAIN KING PHARMACEUTICALS INC (US) 2011-04-27 EP disclosed
EP-1383463-A4 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE KING PHARMACEUTICALS INC (US) 2009-03-25 EP disclosed
US-7449490-B2 Pharmaceutically active compounds and methods of use KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. (US) 2008-11-11 US disclosed
US-7101905-B2 Pharmaceutically active compounds and methods of use KING PHARMACEUTICALS RESEARCH & DEVELOPMENT, INC. (US) 2006-09-05 US disclosed
US-20060183921-A1 Pharmaceutically active compounds and methods of use KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2006-08-17 US disclosed
EP-1383463-A2 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE King Pharmaceuticals, Inc. (US) 2004-01-28 EP disclosed
US-20030073733-A1 Pharmaceutically active compounds and methods of use KING PHARMACEUTICALS RESEARCH AND DEVELOPMENT, INC. 2003-04-17 US disclosed
WO-2002083083-A2 PHARMACEUTICALLY ACTIVE COMPOUNDS AND METHODS OF USE KING PHARMACEUTICALS, INC. (US) 2002-10-24 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-20060183921-A1 Pharmaceutically active compounds and methods of use TRPV1, TPMT, ACHE PTPN1 2647/4885MAPT 1176/4885ALDH1A1 1591/4885
US-20030073733-A1 Pharmaceutically active compounds and methods of use TRPV1, TPMT, ACHE PTPN1 2647/4885MAPT 1176/4885ALDH1A1 1591/4885

“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.