SCHEMBL1950817

SCHEMBL1950817

CCOC(=O)COc1cccc(C=O)c1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.56
▸ ALDH1A1 P00352 4/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ LMNA P02545 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ SMN1; SMN2 Q16637 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ S1PR4 O95977 1/20 0.52
▸ ITGA4 P13612 1/20 0.52
▸ HPGD P15428 1/20 0.52
▸ S1PR1 P21453 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ TLR9 Q9NR96 1/20 0.52
▸ PLA2G1B P04054 1/20 0.49
▸ ATG4B Q9Y4P1 1/20 0.49
▸ CA1 P00915 1/20 0.48
▸ CA2 P00918 1/20 0.48

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
SCHEMBL74619 0.89 ALDH1A1 (0.65) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL20068038 0.88 ALDH1A1 (0.56) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL2654658 0.86 NPC1 (0.45) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL5883219 0.84 USP2 (0.72) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL28657631 0.84 ALDH1A1 (0.53) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL1253039 0.82 CA1 (0.54) ALDH1A1CYP1A2CYP2C19LMNASMN1; SMN2
SCHEMBL13035496 0.82 USP2 (0.58) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL1948055 0.82 USP2 (0.58) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL29143303 0.82 ALDH1A1 (0.53) USP2ALDH1A1CYP1A2CYP2C19LMNA
SCHEMBL27254470 0.81 USP2 (0.51) USP2ALDH1A1CYP1A2CYP2C19LMNA

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
EP-2507237-A1 IMIDAZOQUINOLINES WHICH ACT VIA TOLL - LIKE RECEPTORS (TLR) Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-10-10 — — EP disclosed
WO-2011068233-A1 IMIDAZOQUINOLINES WHICH ACT VIA TOLL - LIKE RECEPTORS (TLR) DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-06-09 — — WO disclosed
US-20110136801-A1 Novel Compounds DAINIPPON SUMITOMO PHARMA CO. LTD. (JP) 2011-06-09 — — 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-20110136801-A1 Novel Compounds C1R, RB1, CNKSR1 USP2 4447/4885ALDH1A1 173/4885CYP1A2 288/4885

“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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