SCHEMBL5527733

SCHEMBL5527733

Fc1ccccc1OCC1CCC2(CC1)OCCO2

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
HPGD P15428 2/20 0.39
DGAT1 O75907 1/20 0.39
RIPK1 Q13546 1/20 0.38
POLB P06746 1/20 0.38
HTR2C P28335 5/20 0.38
KCNN4 O15554 1/20 0.38
FKBP1A P62942 1/20 0.37
HTR2A P28223 2/20 0.36
HTR2B P41595 2/20 0.36

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
SCHEMBL12366390 0.89 SLC6A2 (0.36) RIPK1HTR2CKCNN4HTR2AHTR2B
SCHEMBL5525469 0.86 KDM4E (0.46) KDM4EHPGDFKBP1A
SCHEMBL12366333 0.81 ALDH1A1 (0.38) KDM4EHPGDRIPK1HTR2CHTR2A
SCHEMBL12181170 0.81 RIPK1 (0.53) HPGDDGAT1RIPK1POLBHTR2C
SCHEMBL5524579 0.79 GPR119 (0.44)
SCHEMBL14451418 0.79 HPGD (0.41) HPGDDGAT1RIPK1HTR2CHTR2A
SCHEMBL1013733 0.79 ALDH1A1 (0.39) HTR2CHTR2AHTR2B
SCHEMBL5523249 0.78 IDO1 (0.38) POLB
Hydrochloric Acid SCHEMBL5524825 0.78 HTR2C (0.42) HPGDDGAT1POLBHTR2CHTR2A
Hydrochloric Acid SCHEMBL5524833 0.78 HTR2C (0.42) HPGDDGAT1POLBHTR2CHTR2A

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-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
EP-1716100-A2 THERAPEUTIC AMIDE DERIVATIVES Pfizer, Inc. (US) 2006-11-02 EP disclosed
WO-2005080317-A2 THERAPEUTIC AMIDE DERIVATIVES PFIZER JAPAN, INC. (JP) 2005-09-01 WO disclosed
WO-2005080317-A2 THERAPEUTIC AMIDE DERIVATIVES PFIZER JAPAN, INC. (JP) 2005-09-01 WO 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-20070167452-A1 Therapeutic amide derivatives GRIN1, GRIN2B, GRIN3A KDM4E 2535/4885HPGD 604/4885DGAT1 2495/4885

“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.