SCHEMBL5970367

SCHEMBL5970367

NCc1ccc(C(=O)Nc2ccc(C(=O)O)c(-c3ccccc3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.53
PKM P14618 1/20 0.52
KMT2A Q03164 1/20 0.52
NR1H4 Q96RI1 2/20 0.50
GALK1 P51570 1/20 0.50
CASP6 P55212 1/20 0.50
MCL1 Q07820 1/20 0.50
PLEC Q15149 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
PLAU P00749 3/20 0.48
PLG P00747 5/20 0.47
KLK1 P06870 4/20 0.47
KLK6 Q92876 4/20 0.47
USP28 Q96RU2 1/20 0.47
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
PLAT P00750 2/20 0.46
KLKB1 P03952 1/20 0.46
PRSS1 P07477 1/20 0.46
HPSE Q9Y251 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
Hydrochloric Acid SCHEMBL6707045 0.99 HDAC1 (0.52) HDAC1PKMKMT2ANR1H4GALK1
SCHEMBL27650066 0.79 CSNK2A1 (0.53) HDAC1
SCHEMBL6677659 0.78 PTPN1 (0.65) HDAC1KMT2ANR1H4PLAUPLG
SCHEMBL1857575 0.78 PTPN1 (0.65) KMT2ANR1H4PLAUPLGKLK1
Hydrochloric Acid SCHEMBL1160775 0.76 PTPN1 (0.62) KMT2ANR1H4PLAUPLGKLK1
SCHEMBL28241907 0.76 NR1H4 (0.77) HDAC1KMT2ANR1H4PLAUPLG
SCHEMBL24892329 0.76 PLAU (0.69) PKMKMT2ANR1H4TDP1PLAU
SCHEMBL27716606 0.74 HDAC1 (0.69) HDAC1PKMKMT2ATDP1
SCHEMBL11791029 0.74 PLAU (0.44) PKMKMT2APLAUPLATPPARG
SCHEMBL21753699 0.74 MGLL (0.57) KMT2A

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
US-20040110959-A1 Antiangiogenic drug to treat cancer, arthritis and retinopathy ABBVIE INC. 2004-06-10 US claimed
EP-1080070-A2 ANTIANGIOGENIC DRUG TO TREAT CANCER, ARTHRITIS AND RETINOPATHY ABBOTT LABORATORIES (US) 2001-03-07 EP claimed
WO-1999061406-A2 ANTIANGIOGENIC DRUG TO TREAT CANCER, ARTHRITIS AND RETINOPATHY ABBOTT LABORATORIES (US) 1999-12-02 WO claimed
EP-1080070-B1 ANTIANGIOGENIC DRUG TO TREAT CANCER, ARTHRITIS AND RETINOPATHY ABBOTT LAB (US) 2006-11-22 EP disclosed
US-6849757-B2 Antiangiogenic drug to treat cancer, arthritis and retinopathy ABBOTT LABORATORIES (US) 2005-02-01 US disclosed
US-20040110959-A1 Antiangiogenic drug to treat cancer, arthritis and retinopathy ABBVIE INC. 2004-06-10 US disclosed
US-6632961-B1 Pharmaceutically acceptable salts or prodrugs thereof, are useful for treating pathological states which arise from or are exacerbated by angiogenesis. The invention also relates to pharmaceutical compositions comprising these compounds and to ABBOTT LABORATORIES 2003-10-14 US disclosed
EP-1080070-A2 ANTIANGIOGENIC DRUG TO TREAT CANCER, ARTHRITIS AND RETINOPATHY ABBOTT LABORATORIES (US) 2001-03-07 EP disclosed
WO-1999061406-A2 ANTIANGIOGENIC DRUG TO TREAT CANCER, ARTHRITIS AND RETINOPATHY ABBOTT LABORATORIES (US) 1999-12-02 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 (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-20040110959-A1 Antiangiogenic drug to treat cancer, arthritis and retinopathy FLT1, VEGFA, KDR HDAC1 562/4885PKM 3261/4885KMT2A 4285/4885

“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.