SCHEMBL3731595

SCHEMBL3731595

Cc1cc(C)cc(OCCC(=O)O)c1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.67
▸ MCL1 Q07820 2/20 0.66
▸ TSHR P16473 2/20 0.46
▸ RXRA P19793 1/20 0.46
▸ RXRB P28702 1/20 0.46
▸ RXRG P48443 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ MMP2 P08253 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL2280556 0.90 TSHR (0.57) L3MBTL1MCL1TSHRSMN1; SMN2TP53
SCHEMBL22434873 0.89 L3MBTL1 (0.59) L3MBTL1MCL1TSHRLMNA
SCHEMBL15048513 0.89 L3MBTL1 (0.53) L3MBTL1MCL1TSHRTP53ALOX15
SCHEMBL7375365 0.82 MCL1 (0.46) L3MBTL1MCL1SMN1; SMN2TP53ALOX15
SCHEMBL2777259 0.82 L3MBTL1 (0.64) L3MBTL1MCL1SMN1; SMN2LMNAMEN1
SCHEMBL10591492 0.82 MCL1 (0.46) L3MBTL1MCL1SMN1; SMN2TP53ALOX15
SCHEMBL31302989 0.82 L3MBTL1 (0.64) L3MBTL1MCL1SMN1; SMN2LMNAMEN1
Hydrochloric Acid SCHEMBL2777750 0.80 L3MBTL1 (0.62) L3MBTL1MCL1SMN1; SMN2LMNAMEN1
SCHEMBL1806524 0.80 L3MBTL1 (1.00) L3MBTL1MCL1TSHRTP53MMP2
SCHEMBL22578056 0.80 MCL1 (0.61) L3MBTL1MCL1TSHRSMN1; SMN2MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2053918-B1 PROPYL PHENOXY ETHERS FOR USE AS DELIVERY AGENTS EMISPHERE TECH INC (US) 2014-07-23 — — EP disclosed
EP-2053918-B1 PROPYL PHENOXY ETHERS FOR USE AS DELIVERY AGENTS EMISPHERE TECH INC (US) 2014-07-23 — — EP disclosed
US-20100062970-A1 SYNTHESIS OF PROPYL PHENOXY ETHERS AND USE AS DELIVERY AGENTS EMISPHERE TECHNOLOGIES INC. (US) 2010-03-11 — — US disclosed
US-20100062970-A1 SYNTHESIS OF PROPYL PHENOXY ETHERS AND USE AS DELIVERY AGENTS EMISPHERE TECHNOLOGIES INC. (US) 2010-03-11 — — US disclosed
US-20100062970-A1 SYNTHESIS OF PROPYL PHENOXY ETHERS AND USE AS DELIVERY AGENTS EMISPHERE TECHNOLOGIES INC. (US) 2010-03-11 — — 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-20100062970-A1 SYNTHESIS OF PROPYL PHENOXY ETHERS AND USE AS DELIVERY AGENTS EPX, HPD, CYP2C8 L3MBTL1 3481/4885MCL1 1978/4885TSHR 3844/4885

“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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