SCHEMBL13939445

SCHEMBL13939445

COc1ccc(C(Cl)(c2ccc(OC)cc2)c2ccc(OCCCCCC(=O)ON3C(=O)CCC3=O)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KMT2A Q03164 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ POLB P06746 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ FFAR1 O14842 1/20 0.37
▸ PPARG P37231 1/20 0.37
▸ PPARD Q03181 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HDAC3 O15379 1/20 0.36
▸ STAT3 P40763 1/20 0.36
▸ HDAC4 P56524 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36

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
SCHEMBL13964305 0.90 ALOX12 (0.40) ALOX12SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL13964354 0.86 ALOX12 (0.44) ALOX12SMN1; SMN2KMT2AMAPTPOLB
SCHEMBL6437142 0.85 MAPT (0.41) ALOX12SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL13939362 0.85 MAPT (0.41) ALOX12SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL13964488 0.84 GAA (0.38) SMN1; SMN2HPGDKMT2AMAPTPOLB
SCHEMBL13939438 0.83 F2RL1 (0.44) SMN1; SMN2KMT2AMAPTPOLBATM
SCHEMBL15176976 0.80 L3MBTL1 (0.48) ALOX12SMN1; SMN2HPGDKMT2AMAPT
SCHEMBL13939428 0.79 HDAC1 (0.40) SMN1; SMN2HPGDKMT2AMAPTPOLB
SCHEMBL6439325 0.79 PPARA (0.56) MAPTFFAR1PPARGPPARDPPARA
SCHEMBL1744893 0.77 GPR119 (0.41) ALOX12SMN1; SMN2KMT2AMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090023926-A1 Trityl Derivatives for Enhancing Mass Spectrometry OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2009-01-22 — — US disclosed
US-20090023926-A1 Trityl Derivatives for Enhancing Mass Spectrometry OXFORD GENE TECHNOLOGY IP LIMITED (GB) 2009-01-22 — — US 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-20090023926-A1 Trityl Derivatives for Enhancing Mass Spectrometry F3, TBCA, GYPA ALOX12 2961/4885SMN1; SMN2 3556/4885HPGD 2067/4885

“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.

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