SCHEMBL544041

SCHEMBL544041

CC(=O)Oc1cccc(OC(C)=O)c1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.69
KDM4E B2RXH2 5/20 0.55
HSD17B10 Q99714 4/20 0.55
ALDH1A1 P00352 3/20 0.55
PTGS2 P35354 3/20 0.55
BLM P54132 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
HPGD P15428 2/20 0.55
ESR1 P03372 1/20 0.55
ITGB3 P05106 1/20 0.55
ITGA2B P08514 1/20 0.55
HMGB1 P09429 1/20 0.55
TSHR P16473 1/20 0.55
GGT1 P19440 1/20 0.55
PTGS1 P23219 1/20 0.55
NAPRT Q6XQN6 1/20 0.55
MAPK1 P28482 1/20 0.55
PTPN1 P18031 1/20 0.51
LMNA P02545 3/20 0.50
NPC1 O15118 1/20 0.49

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
SCHEMBL544172 0.92 ACHE (0.61) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL742810 0.89 ACHE (0.62) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL31229899 0.89 ACHE (0.62) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL544758 0.87 ACHE (0.61) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL907658 0.87 ACHE (0.61) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL11585900 0.87 ACHE (0.61) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL16335017 0.86 ACHE (0.59) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL868843 0.86 ACHE (0.59) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL21728175 0.86 ACHE (0.59) ACHEKDM4EHSD17B10ALDH1A1PTGS2
SCHEMBL8320198 0.86 ACHE (0.59) ACHEKDM4EHSD17B10ALDH1A1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110688-B2 Method for producing indole derivative having piperidine ring EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-02-07 US disclosed
US-8110688-B2 Method for producing indole derivative having piperidine ring EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-02-07 US disclosed
US-8110688-B2 Method for producing indole derivative having piperidine ring EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-02-07 US disclosed
EP-1880995-B1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING EISAI R&D MAN CO LTD (JP) 2011-12-21 EP disclosed
CN-101171249-B Process for preparing indole derivatives having piperidine ring EISAI R&D MAN CO LTD 2010-11-10 CN disclosed
US-20100197926-A1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-05 US disclosed
US-20100197926-A1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-05 US disclosed
US-20100197926-A1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-05 US disclosed
CN-101171249-A Process for preparing indole derivatives having piperidine ring EISAI R&D MAN CO LTD (JP) 2008-04-30 CN disclosed
EP-1880995-A1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING Eisai R&D Management Co., Ltd. (JP) 2008-01-23 EP disclosed
CN-1920667-A Photosensitive slurry SUMITOMO CHEMICAL CO (JP) 2007-02-28 CN disclosed
US-20040259019-A1 Positive photosensitive composition SUMITOMO CHEMICAL COMPANY, LIMITED 2004-12-23 US disclosed
CN-1525248-A Positivity light-sensitive composition 住友化学工业株式会社 2004-09-01 CN 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-20100197926-A1 METHOD FOR PRODUCING INDOLE DERIVATIVE HAVING PIPERIDINE RING IDO2, IDO1, TPH2 ACHE 741/4885KDM4E 227/4885HSD17B10 1552/4885

“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.