SCHEMBL3438522

SCHEMBL3438522

COc1cccc(OC)c1/C=C1/CCCCC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.51
ALDH1A1 P00352 5/20 0.46
HTT P42858 1/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 3/20 0.46
ALOX15 P16050 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MAPT P10636 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
USP2 O75604 1/20 0.42
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NOD2 Q9HC29 2/20 0.41
NFE2L2 Q16236 1/20 0.40
AKR1C3 P42330 1/20 0.40

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
SCHEMBL3438524 1.00 EGFR (0.51) EGFRALDH1A1HTTGAALMNA
SCHEMBL17899574 0.85 MEN1 (0.57) EGFRHTTGAALMNAHPGD
SCHEMBL3438150 0.82 EGFR (0.59) EGFRALDH1A1HTTGAALMNA
SCHEMBL3438149 0.82 EGFR (0.59) EGFRALDH1A1HTTGAALMNA
SCHEMBL3438405 0.81 RAB9A (0.61) EGFRALDH1A1GAAHPGDALOX15
SCHEMBL3438404 0.81 RAB9A (0.61) EGFRALDH1A1GAAHPGDALOX15
SCHEMBL1525054 0.79 EGFR (0.63) EGFRALDH1A1HTTGAALMNA
SCHEMBL30825519 0.79 EGFR (0.63) EGFRALDH1A1HTTGAALMNA
SCHEMBL9299869 0.79 EGFR (0.63) EGFRALDH1A1HTTGAALMNA
SCHEMBL1525052 0.79 EGFR (0.63) EGFRALDH1A1HTTGAALMNA

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 3278/4885ALDH1A1 1026/4885HTT 2366/4885

“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.