SCHEMBL1552292

SCHEMBL1552292

Cc1ccc2c(c1)C(Nc1nc(N)nc(C(C)(C)F)n1)C(C)C2

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
HTR6 P50406 1/20 0.34
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL1552303 1.00 HTR1A (0.34) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL1552530 1.00 HTR1A (0.34) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL21524849 0.91 HTR1A (0.32) HTR1AHTR2AHTR7HTR6
SCHEMBL1551863 0.89 KCNH2 (0.33) LMNAMAPTKDM4ENPC1ALOX15
SCHEMBL1551921 0.89 KCNH2 (0.33) LMNAMAPTKDM4ENPC1ALOX15
SCHEMBL1552319 0.89 KCNH2 (0.33) LMNAMAPTKDM4ENPC1ALOX15
SCHEMBL1552567 0.85 TSHR (0.35) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL1551812 0.85 TSHR (0.35) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL1552278 0.85 TSHR (0.35) HTR1AHTR2AHTR7HTR6LMNA
SCHEMBL1552565 0.85 TSHR (0.35) HTR1AHTR2AHTR7HTR6LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47666-E1 Herbicidal compositions BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-29 US disclosed
US-RE46095-E1 Herbicidal compositions BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-08-09 US disclosed
US-RE46095-E1 Herbicidal compositions BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-08-09 US disclosed
US-8586503-B2 Herbicidal compositions BAYER CROPSCIENCE AG (DE) 2013-11-19 US disclosed
US-8426342-B2 Method for weed control in lawn BAYER CROPSCIENCE AG (DE) 2013-04-23 US disclosed
US-8426342-B2 Method for weed control in lawn BAYER CROPSCIENCE AG (DE) 2013-04-23 US disclosed
US-8236729-B2 Synergistic mixtures BAYER CROPSCIENCE AG (DE) 2012-08-07 US disclosed
EP-2012588-B1 AQUEOUS SUSPENSION CONCENTRATE BAYER CROPSCIENCE AG (DE) 2011-04-27 EP disclosed
US-20100048399-A1 HERBICIDAL COMPOSITIONS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-02-25 US disclosed
US-20100016158-A1 METHOD FOR WEED CONTROL IN LAWN BAYER CROPSCIENCE AG (DE) 2010-01-21 US disclosed
EP-1854355-A1 Aqueous suspension concentrates Bayer CropScience AG (DE) 2007-11-14 EP disclosed
US-20070219095-A1 AQUEOUS SUSPENSION CONCENTRATES BAYER CROPSCIENCE GMBH (DE) 2007-09-20 US disclosed
EP-1790227-A1 Aqueous suspension-concentrates of 2,4-diamino-s-triazine herbicides Bayer CropScience AG (DE) 2007-05-30 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-20100016158-A1 METHOD FOR WEED CONTROL IN LAWN NOTUM, RDX, WASF2 HTR1A 3362/4885HTR2A 4310/4885HTR7 4257/4885
US-20100048399-A1 HERBICIDAL COMPOSITIONS KCNH1, HRH4, KCNH2 HTR1A 2088/4885HTR2A 2334/4885HTR7 2053/4885
US-20070219095-A1 AQUEOUS SUSPENSION CONCENTRATES SLC43A1, AS3MT, SLC7A5 HTR1A 1236/4885HTR2A 425/4885HTR7 915/4885

“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.