SCHEMBL346711

SCHEMBL346711

c1ccc(P(CCNCCNCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SIGMAR1 Q99720 8/20 0.38
CYP3A4 P08684 1/20 0.38
CHRM2 P08172 1/20 0.35
DRD2 P14416 1/20 0.34
DRD4 P21917 1/20 0.34
DRD3 P35462 1/20 0.34
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
MAOA P21397 1/20 0.32
KCNH2 Q12809 1/20 0.31

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
SCHEMBL951191 0.98 SIGMAR1 (0.39) TDP1MEN1KMT2ASIGMAR1CYP3A4
Hydrochloric Acid SCHEMBL1465772 0.95 SIGMAR1 (0.38) TDP1MEN1KMT2ASIGMAR1CYP3A4
SCHEMBL31026596 0.95 SIGMAR1 (0.38) TDP1MEN1KMT2ASIGMAR1CYP3A4
SCHEMBL1465693 0.91 SIGMAR1 (0.35) TDP1MEN1KMT2ASIGMAR1CYP3A4
SCHEMBL19265778 0.89 SIGMAR1 (0.43) SIGMAR1CHRM2DRD2DRD4DRD3
SCHEMBL20706230 0.87 SMN1; SMN2 (0.43) SMN1; SMN2
Carbon Monoxide SCHEMBL31488742 0.87 SIGMAR1 (0.33) TDP1MEN1KMT2ASIGMAR1CYP3A4
SCHEMBL19933254 0.87 SIGMAR1 (0.39) TDP1MEN1KMT2ASIGMAR1CYP3A4
SCHEMBL18216551 0.87 HDAC3 (0.33) TDP1MEN1KMT2ASIGMAR1CYP3A4
Carbon Monoxide SCHEMBL30049536 0.86 SIGMAR1 (0.32) TDP1MEN1KMT2ASIGMAR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 US disclosed
US-8048982-B2 Method for producing aromatic compound polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-01 US disclosed
EP-2241548-A1 Vanadium di-nuclear complex Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
EP-2241547-A1 Method for producing aromatic compound polymer Sumitomo Chemical Company, Limited (JP) 2010-10-20 EP disclosed
US-20090018309-A1 Method for Producing Aromatic Compound Polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-15 US disclosed
EP-1767560-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER Sumitomo Chemical Company, Limited (JP) 2007-03-28 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 (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-20090018309-A1 Method for Producing Aromatic Compound Polymer PAH, MAOA, AHR TDP1 1286/4885MEN1 4081/4885KMT2A 674/4885
US-20120016147-A1 METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER PAH, MAOA, AHR TDP1 1336/4885MEN1 4122/4885KMT2A 715/4885

“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.