SCHEMBL2291395

SCHEMBL2291395

O=C(Oc1ccc(Br)c(CBr)c1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 12/20 0.55
MAPT P10636 6/20 0.55
MEN1 O00255 4/20 0.55
TDP1 Q9NUW8 3/20 0.55
PARP10 Q53GL7 1/20 0.47
CA12 O43570 2/20 0.46
CA9 Q16790 2/20 0.46
POLB P06746 1/20 0.46
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PKM P14618 1/20 0.45
HSD17B10 Q99714 1/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
RAB9A P51151 1/20 0.43
CA2 P00918 1/20 0.42

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
SCHEMBL27777976 0.88 KMT2A (0.53) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL2292899 0.80 KMT2A (0.47) KMT2AMAPTMEN1TDP1CA12
SCHEMBL2294115 0.79 LMNA (0.46) KMT2AMAPTMEN1TDP1CA12
SCHEMBL2291481 0.78 KMT2A (0.46) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL27777978 0.77 KMT2A (0.53) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL27883921 0.76 KMT2A (0.55) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL7616356 0.76 CES2 (0.59) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL4216005 0.75 KMT2A (0.54) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL9339348 0.74 KMT2A (0.53) KMT2AMAPTMEN1TDP1PARP10
SCHEMBL725405 0.74 PARP10 (0.77) KMT2AMAPTMEN1TDP1PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2149545-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-10-05 EP disclosed
US-7994367-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-09 US disclosed
US-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 US disclosed
EP-2149545-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-03 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 (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-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, C9, TRPA1 KMT2A 481/4885MAPT 3284/4885MEN1 186/4885

“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.