SCHEMBL1555352

SCHEMBL1555352

CC(=O)c1ccc(NC=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.54
RAB9A P51151 6/20 0.54
NPC1 O15118 6/20 0.54
SMN1; SMN2 Q16637 5/20 0.54
KDM4E B2RXH2 1/20 0.54
TAAR1 Q96RJ0 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
HTT P42858 1/20 0.48
NLRP1 Q9C000 1/20 0.48
ALDH1A1 P00352 4/20 0.48
CYP1A1 P04798 1/20 0.47
CYP1B1 Q16678 1/20 0.47
LMNA P02545 4/20 0.45
HPGD P15428 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HSD17B1 P14061 1/20 0.43
TP53 P04637 1/20 0.43
MAPK1 P28482 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
SCHEMBL10601664 0.83 MAPT (0.54) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL15453215 0.82 ALDH1A1 (0.52) MAPTRAB9ANPC1SMN1; SMN2KMT2A
SCHEMBL12294284 0.81 LMNA (0.47) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL6251433 0.81 RAB9A (0.53) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL1086165 0.80 ALDH1A1 (0.56) RAB9ASMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL13026260 0.79 HDAC2 (0.55) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL2345447 0.79 ALDH1A1 (0.60) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL7885609 0.78 ALDH1A1 (0.48) MAPTSMN1; SMN2KDM4EKMT2AALDH1A1
SCHEMBL1086084 0.78 ALDH1A1 (0.54) RAB9ASMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL1176396 0.78 SMN1; SMN2 (0.61) MAPTRAB9ANPC1SMN1; SMN2KDM4E

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
WO-2023125530-A1 ANTIBODY DRUG CONJUGATES BEIGENE, LTD. (KY) 2023-07-06 WO disclosed
EP-4198060-A1 POLYSACCHARIDE DERIVATIVE, POLYSACCHARIDE DERIVATIVE-DRUG CONJUGATE, AND METHOD FOR PRODUCING SAME The University of Tokyo (JP) 2023-06-21 EP disclosed
WO-2022125804-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 WO disclosed
EP-3157515-B1 PLATINUM COMPOUNDS, COMPOSITIONS, AND USES THEREOF PLACON THERAPEUTICS INC (US) 2021-05-26 EP disclosed
EP-3797768-A1 MALEIMIDE-FUNCTIONALISED PLATINUM FOR USE IN THE TREATMENT OF CANCER Placon Therapeutics, Inc. (US) 2021-03-31 EP disclosed
US-20170340749-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2017-11-30 US disclosed
US-9669102-B2 Cytotoxic benzodiazepine derivatives IMMUNOGEN, INC. (US) 2017-06-06 US disclosed
US-20160367698-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES IMMUNOGEN, INC. 2016-12-22 US disclosed
WO-2004002960-A1 SUBSTITUTED QUINOLINE CCR5 RECEPTOR ANTAGONISTS SCHERING AKTIENGESELLSCHAFT (DE) 2004-01-08 WO 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
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP disclosed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US disclosed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO disclosed
EP-0512352-B1 Substituted carboxylic acid derivatives HOFFMANN LA ROCHE (CH) 1996-03-27 EP disclosed
US-5344843-A Carnitine acryltransferase enzyme inhibitors as antiischemic agents and for cardiovascular disorders HOFFMAN-LA ROCHE INC. (US) 1994-09-06 US disclosed
EP-0512352-A2 Substituted carboxylic acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1992-11-11 EP 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 (3 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-20160367698-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 MAPT 4072/4885RAB9A 2398/4885NPC1 515/4885
US-20030073733-A1 Pharmaceutically active compounds and methods of use TRPV1, TPMT, ACHE MAPT 1176/4885RAB9A 1503/4885NPC1 931/4885
US-20170340749-A1 CYTOTOXIC BENZODIAZEPINE DERIVATIVES GABRA6, GABBR1, GABRA5 MAPT 4072/4885RAB9A 2398/4885NPC1 515/4885

“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.