SCHEMBL4977234

SCHEMBL4977234

COc1ccc(OC)c(C)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ NNMT P40261 1/20 0.50
▸ SLC6A2 P23975 4/20 0.41
▸ SLC6A4 P31645 4/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PDE10A Q9Y233 5/20 0.41
▸ NQO2 P16083 1/20 0.40
▸ PDE2A O00408 2/20 0.40
▸ ACHE P22303 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ TGFBR1 P36897 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ NQO1 P15559 1/20 0.37

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
SCHEMBL13518972 0.83 NNMT (0.44) KDM4EL3MBTL1NNMTSLC6A2SLC6A4
SCHEMBL28755607 0.80 L3MBTL1 (0.43) KDM4EL3MBTL1NNMTSLC6A2SLC6A4
SCHEMBL31189712 0.80 NNMT (0.46) KDM4EL3MBTL1NNMTSLC6A2SLC6A4
SCHEMBL12036800 0.80 NNMT (0.42) KDM4EL3MBTL1NNMTSLC6A2SLC6A4
SCHEMBL4573187 0.79 KDM4E (0.50) KDM4EL3MBTL1KMT2ANQO2ACHE
SCHEMBL172558 0.78 NNMT (0.52) NNMTCYP1A2KMT2APDE10APDE2A
SCHEMBL7849024 0.78 KDM4E (0.53) KDM4EL3MBTL1KMT2ANQO2ACHE
SCHEMBL12093603 0.76 KDM4E (0.52) KDM4EL3MBTL1NQO2ACHEMAPT
SCHEMBL22621616 0.76 POLB (0.52) KDM4ENNMTCYP1A2KMT2APDE10A
SCHEMBL586194 0.76 NNMT (0.39) KDM4EL3MBTL1NNMTSLC6A2SLC6A4

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
US-20080119518-A1 1-(Piperidin-4- Yl)-1H-Indole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-05-22 — — US disclosed
US-20080119518-A1 1-(Piperidin-4- Yl)-1H-Indole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-05-22 — — US disclosed
US-20080119518-A1 1-(Piperidin-4- Yl)-1H-Indole Derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2008-05-22 — — US disclosed
EP-1847535-A1 1-(PIPERIDIN-4-YL)-1H-INDOLE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2007-10-24 — — EP disclosed
CN-1084736-C Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals HOECHST AG (DE) 2002-05-15 — — CN disclosed
CN-1107144-A Substituted heterocyclic carboxamide esters, their preparation and their use as pharmaceuticals HOECHST AG (DE) 1995-08-23 — — 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-20080119518-A1 1-(Piperidin-4- Yl)-1H-Indole Derivatives TPH1, HTR1D, HTR1B KDM4E 1637/4885L3MBTL1 2827/4885NNMT 2330/4885

“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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