SCHEMBL2106591

SCHEMBL2106591

CSc1nc(N)nc(NC(C)C)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.53
HSP90AB1 P08238 2/20 0.48
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 4/20 0.40
HTT P42858 2/20 0.39
F2 P00734 1/20 0.37
LMNA P02545 1/20 0.37
HRH4 Q9H3N8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
Prometryn SCHEMBL7657627 0.86 MAPK1 (0.56) MAPK1TSHRSMN1; SMN2HSD17B10GAA
Prometryn SCHEMBL7622 0.86 MAPK1 (0.56) MAPK1TSHRSMN1; SMN2HSD17B10GAA
Prometryn SCHEMBL9534325 0.84 MAPK1 (0.43) MAPK1HSP90AB1TSHRSMN1; SMN2HSD17B10
Prometryn SCHEMBL20723889 0.84 GAA (0.58) MAPK1TSHRSMN1; SMN2HSD17B10GAA
SCHEMBL8059674 0.81 GAA (0.58) MAPK1GAATDP1KMT2AALDH1A1
SCHEMBL8059668 0.81 GAA (0.52) MAPK1GAATDP1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL11478940 0.79 GAA (0.50) MAPK1GAATDP1KMT2AALDH1A1
SCHEMBL24059309 0.78 MAPK1 (0.50) MAPK1HSP90AB1TSHRSMN1; SMN2HSD17B10
SCHEMBL29435432 0.78 MAPK1 (0.50) MAPK1TSHRSMN1; SMN2HSD17B10GAA
SCHEMBL8827500 0.78 MAPK1 (0.50) MAPK1TSHRSMN1; SMN2HSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110218105-A1 PRE-PLANT OR PRE-EMERGENT HERBICIDE COMPOSITIONS WALKER LARRY 2011-09-08 US claimed
CN-101578046-A herbicidal composition ISAGRO SPA (IT) 2009-11-11 CN claimed
EP-1998616-A1 NEW SYNERGISTIC HERBICIDAL COMPOSITIONS Isagro Ricerca S.r.l. (IT) 2008-12-10 EP claimed
WO-2007101587-A1 NEW SYNERGISTIC HERBICIDAL COMPOSITIONS ISAGRO RICERCA S.R.L. (IT) 2007-09-13 WO claimed
EP-1429612-A1 HERBICIDES CONTAINING SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONE Bayer CropScience AG (DE) 2004-06-23 EP claimed
WO-2003026426-A1 HERBICIDES CONTAINING SUBSTITUTED THIEN-3-YL-SULFONYLAMINO(THIO)CARBONYL-TRIAZOLIN(THI)ONE BAYER CROPSCIENCE AG (DE) 2003-04-03 WO claimed
US-20240226160-A9 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-07-11 US disclosed
US-20240131072-A1 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN SEATTLE CHILDREN'S HOSPITAL D/B/A SEATTLE CHILDREN'S RESEARCH INSTITUTE (US) 2024-04-25 US disclosed
EP-4291571-A2 ACTIVITY-INDUCIBLE FUSION PROTEINS HAVING A HEAT SHOCK PROTEIN 90 BINDING DOMAIN Seattle Children's Hospital d/b/a Seattle Children's Research Institute (US) 2023-12-20 EP disclosed
WO-2023220440-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-11-16 WO disclosed
US-20230322925-A1 PHOSPHOLIPID ETHER (PLE) CAR T CELL TUMOR TARGETING (CTCT) AGENTS SEATTLE CHILDREN’S HOSPITAL DBA SEATTLE CHILDREN’S RES INSTITUTE (US) 2023-10-12 US disclosed
US-20230203484-A1 DOUBLE STRANDED OLIGONUCLEOTIDE COMPOSITIONS AND METHODS RELATING THERETO WAVE LIFE SCIENCES LTD. (SG) 2023-06-29 US disclosed
US-20230203087-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF WAVE LIFE SCIENCES LTD. (SG) 2023-06-29 US disclosed
WO-2003020035-A2 SELECTIVE HERBICIDE COMPRISING A TETRAZOLINONE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2003-03-13 WO disclosed
EP-0787429-B1 Application of a composition for regulating plant growth NIHON NOHYAKU CO LTD (JP) 2001-12-12 EP disclosed
US-20010039321-A1 Siloxane-containing oil compositions with good spreading properties EVONIK GOLDSCHMIDT GMBH (DE) 2001-11-08 US disclosed
EP-1136515-A2 Siloxane-containing oil compositions with good spreading properties Goldschmidt AG (DE) 2001-09-26 EP disclosed
CN-1309533-A Herbicidal composition AVENTIS CORPSCIENCE GMBH (DE) 2001-08-22 CN disclosed
US-6117818-A COMPRISES AS AN ACTIVE INGREDIENT AT LEAST ONE 3-SUBSTITUTED PHENYLPYRAZOLE DERIVATIVE WHICH ACTS AS A DESICCANT OR DEFOLIANT FOR ROOT VEGETABLES, FIBER CROPS, OIL CROPS NIHON NOHYAKU CO., LTD. (JP) 2000-09-12 US disclosed
EP-0787429-A2 A composition for regulating plant growth and a method for application thereof NIHON NOHYAKU CO., LTD. (JP) 1997-08-06 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-20230203087-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS THEREOF RNGTT, NSUN2, ALKBH1 MAPK1 3843/4885HSP90AB1 4862/4885TSHR 4131/4885
US-20110218105-A1 PRE-PLANT OR PRE-EMERGENT HERBICIDE COMPOSITIONS TPH1, DDT, MTX1 MAPK1 4143/4885HSP90AB1 1991/4885TSHR 3906/4885
US-20230322925-A1 PHOSPHOLIPID ETHER (PLE) CAR T CELL TUMOR TARGETING (CTCT) AGENTS PHOSPHO1, LCAT, CD47 MAPK1 2931/4885HSP90AB1 2958/4885TSHR 1224/4885

“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.