SCHEMBL20095263

SCHEMBL20095263

C=CCCC(=O)Oc1ccc(CI)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
THRB P10828 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36
EGFR P00533 2/20 0.33
ERBB2 P04626 2/20 0.33
ELANE P08246 1/20 0.33
ESR1 P03372 1/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL21994120 0.85 THRB (0.45) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL29034906 0.83 KMT2A (0.46) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL29034769 0.80 KMT2A (0.55) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL11336269 0.80 KMT2A (0.47) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL15567082 0.80 KMT2A (0.46) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL114036 0.80 PRSS1 (0.46) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL8439628 0.78 KMT2A (0.41) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL29912900 0.77 ASAH1 (0.45) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL29034760 0.76 SMN1; SMN2 (0.47) KMT2AALDH1A1LMNAMAPTHTT
SCHEMBL11362243 0.76 KMT2A (0.53) KMT2AALDH1A1LMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180110867-A1 CONJUGATE OF POLYETHYLENE GLYCOL AND ANESTHETIC, AND PREPARATION METHOD THEREOF JENKEM TECHNOLOGY CO., LTD. (TIANJIN) (CN) 2018-04-26 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-20180110867-A1 CONJUGATE OF POLYETHYLENE GLYCOL AND ANESTHETIC, AND PREPARATION METHOD THEREOF OPRL1, OGFR, F12 KMT2A 1586/4885ALDH1A1 945/4885LMNA 3588/4885

“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.