SCHEMBL3438401

SCHEMBL3438401

COc1ccc(/C=C2/CC(c3ccccn3)CCC2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 3/20 0.46
DYRK1B Q9Y463 3/20 0.46
CLK1 P49759 2/20 0.46
MAPT P10636 3/20 0.45
CYP1A2 P05177 1/20 0.45
KMT2A Q03164 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
HSD11B1 P28845 1/20 0.41
ALDH1A1 P00352 3/20 0.41
GRM7 Q14831 1/20 0.41
EGFR P00533 1/20 0.41
MAOB P27338 2/20 0.40
MEN1 O00255 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MIF P14174 1/20 0.39

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
SCHEMBL3438131 0.92 KMT2A (0.46) DYRK1ADYRK1BCLK1MAPTCYP1A2
SCHEMBL3438135 0.92 KMT2A (0.46) DYRK1ADYRK1BCLK1MAPTCYP1A2
SCHEMBL3437957 0.88 NPC1 (0.49) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL3438390 0.86 ALDH1A1 (0.46) MAPTCYP1A2KMT2ANPC1RAB9A
SCHEMBL3438360 0.82 DYRK1A (0.51) DYRK1ADYRK1BCLK1MAPTCYP1A2
SCHEMBL3438362 0.82 DYRK1A (0.51) DYRK1ADYRK1BCLK1MAPTCYP1A2
SCHEMBL3438511 0.81 ALDH1A1 (0.43) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL3438452 0.80 NPC1 (0.51) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL3438455 0.80 NPC1 (0.51) MAPTKMT2ANPC1RAB9AALDH1A1
SCHEMBL3438477 0.78 ALDH1A1 (0.45) MAPTCYP1A2KMT2ANPC1RAB9A

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 DYRK1A 3425/4885DYRK1B 3222/4885CLK1 2927/4885

“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.