SCHEMBL3460372

SCHEMBL3460372

COC(OC)c1ccc(Cl)cc1COc1cc(C(C)C)ccc1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
ALDH1A1 P00352 1/20 0.33
ADRB2 P07550 1/20 0.33
LPAR1 Q92633 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CETP P11597 1/20 0.32
MEN1 O00255 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32
KCNH2 Q12809 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
MRGPRX4 Q96LA9 2/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
MAOB P27338 1/20 0.31
HDAC8 Q9BY41 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
SCHEMBL3466452 0.92 TSHR (0.33) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL1539392 0.87 TSHR (0.34) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL3459389 0.85 CCR5 (0.36) TSHRMAPK1NPSR1ALDH1A1MEN1
SCHEMBL3459134 0.84 MEN1 (0.36) TSHRMAPK1NPSR1LPAR1CYP1A2
SCHEMBL1539394 0.83 TSHR (0.34) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL1539544 0.83 TSHR (0.34) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL1539542 0.83 TSHR (0.34) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL15663009 0.82 MAPK1 (0.37) TSHRMAPK1NPSR1ALDH1A1LMNA
SCHEMBL15402113 0.81 L3MBTL1 (0.40) TSHRMAPK1NPSR1ALDH1A1ADRB2
SCHEMBL15375580 0.81 BCHE (0.39) TSHRMAPK1NPSR1ALDH1A1ADRB2

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-2241546-B1 PROCESS FOR PRODUCTION OF BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-10-04 EP disclosed
US-8258349-B2 Process for production of benzaldehyde compound SUITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-04 US disclosed
US-20100292513-A1 PROCESS FOR PRODUCTION OF BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-18 US disclosed
EP-2241546-A1 PROCESS FOR PRODUCTION OF BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-10-20 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-20100292513-A1 PROCESS FOR PRODUCTION OF BENZALDEHYDE COMPOUND CBR3, ADH5, ALDH1A1 TSHR 3370/4885MAPK1 3791/4885NPSR1 4408/4885

“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.