SCHEMBL3438525

SCHEMBL3438525

O=C1CC(c2ccccc2)CC/C1=C/c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
HTT P42858 2/20 0.53
MAPT P10636 3/20 0.49
HPGD P15428 2/20 0.49
CYP1A2 P05177 2/20 0.49
F3 P13726 1/20 0.46
F2 P00734 3/20 0.46
F10 P00742 3/20 0.46
MAP1LC3B Q9GZQ8 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SRD5A1 P18405 2/20 0.41
GAA P10253 1/20 0.41
MAOB P27338 1/20 0.41
SRD5A2 P31213 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
SCHEMBL3438527 1.00 ALDH1A1 (0.53) ALDH1A1HTTMAPTHPGDCYP1A2
SCHEMBL3438181 0.89 ALDH1A1 (0.54) ALDH1A1HTTMAPTHPGDCYP1A2
SCHEMBL3438182 0.89 ALDH1A1 (0.54) ALDH1A1HTTMAPTHPGDCYP1A2
SCHEMBL3438296 0.86 KMT2A (0.51) ALDH1A1MAPTCYP1A2KMT2AMAOB
SCHEMBL3438294 0.86 KMT2A (0.51) ALDH1A1MAPTCYP1A2KMT2AMAOB
SCHEMBL3438517 0.83 NPC1 (0.56) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL3438518 0.83 NPC1 (0.56) ALDH1A1MAPTHPGDMEN1KMT2A
SCHEMBL3438480 0.80 ALDH1A1 (0.45) ALDH1A1HTTMAPTHPGDCYP1A2
SCHEMBL3437878 0.80 MAP1LC3B (0.48) ALDH1A1HTTMAPTHPGDCYP1A2
SCHEMBL3437875 0.80 MAP1LC3B (0.48) ALDH1A1HTTMAPTHPGDCYP1A2

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 ALDH1A1 1026/4885HTT 2366/4885MAPT 4506/4885

“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.