SCHEMBL3437897

SCHEMBL3437897

COc1ccccc1C=C1C(=O)CCCC1c1ccoc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.38
MIF P14174 1/20 0.37
KMT2A Q03164 4/20 0.37
OPRK1 P41145 1/20 0.37
ALDH1A1 P00352 5/20 0.36
MAPT P10636 3/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
NAT1 P18440 1/20 0.36
LMNA P02545 2/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 2/20 0.35
NFE2L2 Q16236 1/20 0.35
MEN1 O00255 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34

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
SCHEMBL3438069 0.86 KDM4E (0.42) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438070 0.86 KDM4E (0.42) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438513 0.84 CYP1A2 (0.41) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438269 0.81 MAPK1 (0.41) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438457 0.81 MAPK1 (0.41) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438224 0.80 MAPK1 (0.39) EGFRMIFKMT2AALDH1A1MAPT
SCHEMBL3438292 0.80 ALDH1A1 (0.41) MIFKMT2AALDH1A1MAPTGAA
SCHEMBL3437902 0.80 CYP1A2 (0.42) EGFRKMT2AOPRK1ALDH1A1MAPT
SCHEMBL3437969 0.79 CYP3A4 (0.41) EGFRKMT2AALDH1A1KDM4EGAA
SCHEMBL3438506 0.78 NPC1 (0.46) EGFRKMT2AALDH1A1MAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807856-B2 Process for production of 2-Benzylphenol compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2010-10-05 US disclosed
US-20080194882-A1 Process For Production of 2-Benzylphenol Compound IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2008-08-14 US disclosed
EP-1810957-A1 METHOD FOR PRODUCING 2-BENZYLPHENOL COMPOUND Ihara Chemical Industry Co., Ltd. (JP) 2007-07-25 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-20080194882-A1 Process For Production of 2-Benzylphenol Compound CYP1B1, CYP4B1, CYP1A1 EGFR 3278/4885MIF 4794/4885KMT2A 1919/4885

“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.