SCHEMBL3154002

SCHEMBL3154002

O=C(Cc1ccccc1)Oc1ccc(CCl)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.58
KMT2A Q03164 7/20 0.56
HPGD P15428 2/20 0.56
ASAH1 Q13510 1/20 0.54
L3MBTL1 Q9Y468 3/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 2/20 0.49
MAPK1 P28482 1/20 0.49
ATM Q13315 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
PAM P19021 1/20 0.47
TSHR P16473 1/20 0.46

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
SCHEMBL538524 0.85 CYP19A1 (0.76) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL11783599 0.84 KMT2A (0.61) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL11759023 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL27858507 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL27841007 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL4205339 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL28795788 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL11131614 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL8365863 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1
SCHEMBL28071098 0.83 CYP19A1 (0.73) CYP19A1KMT2AHPGDASAH1L3MBTL1

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-2154123-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2013-10-23 EP disclosed
US-7851659-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-12-14 US disclosed
US-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-16 US disclosed
EP-2154123-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-17 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-20100234645-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, NQO2, NDUFC2 CYP19A1 786/4885KMT2A 548/4885HPGD 564/4885

“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.