SCHEMBL3438575

SCHEMBL3438575

COc1ccc(/C=C2/CCC(Oc3ccccc3)CC2=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
DYRK1A Q13627 3/20 0.49
DYRK1B Q9Y463 3/20 0.49
CLK1 P49759 2/20 0.49
MAPT P10636 2/20 0.48
CYP1A2 P05177 1/20 0.48
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
MIF P14174 1/20 0.43
EGFR P00533 2/20 0.43
SERPINE1 P05121 1/20 0.43
MAOB P27338 3/20 0.43
HSP90AA1 P07900 1/20 0.42
CCR6 P51684 1/20 0.42
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41

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
SCHEMBL3438576 1.00 KMT2A (0.50) KMT2ANPC1RAB9ADYRK1ADYRK1B
SCHEMBL3437975 0.90 DYRK1A (0.49) KMT2ANPC1RAB9ADYRK1ADYRK1B
SCHEMBL3437976 0.90 DYRK1A (0.49) KMT2ANPC1RAB9ADYRK1ADYRK1B
SCHEMBL3437890 0.90 ALDH1A1 (0.49) NPC1RAB9AMAPTCYP1A2ALDH1A1
SCHEMBL3437891 0.90 ALDH1A1 (0.49) NPC1RAB9AMAPTCYP1A2ALDH1A1
SCHEMBL3438210 0.88 NPC1 (0.56) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL3438209 0.88 NPC1 (0.56) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL3438492 0.85 NPC1 (0.56) KMT2ANPC1RAB9ADYRK1ADYRK1B
SCHEMBL3438494 0.85 NPC1 (0.56) KMT2ANPC1RAB9ADYRK1ADYRK1B
SCHEMBL3438495 0.81 EGFR (0.46) KMT2ANPC1RAB9AMAPTKDM4E

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 KMT2A 1919/4885NPC1 4280/4885RAB9A 1012/4885

“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.