SCHEMBL13069210

SCHEMBL13069210

O=C(CCN1CCCCC1)c1ccc(O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.73
▸ KMT2A Q03164 6/20 0.73
▸ GFER P55789 1/20 0.71
▸ LMNA P02545 4/20 0.66
▸ MAPT P10636 4/20 0.66
▸ HTT P42858 3/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ POLB P06746 1/20 0.66
▸ TP53 P04637 3/20 0.64
▸ TSHR P16473 2/20 0.64
▸ HPGD P15428 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64
▸ THRB P10828 3/20 0.62
▸ USP2 O75604 1/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ EGFR P00533 2/20 0.62
▸ CYP1A2 P05177 1/20 0.61
▸ CHRM2 P08172 1/20 0.61
▸ CHRM4 P08173 1/20 0.61
▸ CHRM5 P08912 1/20 0.61

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
SCHEMBL8001854 0.98 ALDH1A1 (0.70) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL27710661 0.90 CYP2D6 (0.62) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL27690555 0.88 HTR1A (0.62) ALDH1A1KMT2AGFERMEN1TSHR
SCHEMBL12267314 0.86 ALDH1A1 (0.78) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL11755100 0.85 ALDH1A1 (0.71) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL17033397 0.85 ALDH1A1 (0.72) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL12240720 0.85 ALDH1A1 (0.71) ALDH1A1KMT2AGFERLMNAMAPT
Hydrochloric Acid SCHEMBL908555 0.85 ALDH1A1 (0.79) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL12123614 0.85 ALDH1A1 (0.71) ALDH1A1KMT2AGFERLMNAMAPT
SCHEMBL7389787 0.85 ALDH1A1 (0.53) ALDH1A1KMT2AGFERLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014091384-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF MUCOSITIS KANDULA MAHESH (IN) 2014-06-19 — — WO disclosed
US-20140024677-A1 METHODS FOR INDUCING MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-01-23 — — US disclosed
US-20140024677-A1 METHODS FOR INDUCING MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-01-23 — — US disclosed
EP-1401433-B1 AZOLE ACID DERIVATIVES, ALONE OR IN COMBINATION, FOR TREATING DIABETES AND DYSLIPIDEMIAS; AND FOR TREATING MALIGNANT DISEASES BRISTOL MYERS SQUIBB CO (US) 2010-11-10 — — EP disclosed
US-7452907-B2 Conformationally constrained analogs useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-18 — — US disclosed
US-7452907-B2 Conformationally constrained analogs useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-18 — — 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-20140024677-A1 METHODS FOR INDUCING MITOCHONDRIAL BIOGENESIS TFAM, TXNRD2, CPT1B ALDH1A1 2635/4885KMT2A 2975/4885GFER 4240/4885

“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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