SCHEMBL4143776

SCHEMBL4143776

O=C(c1ccc(O)cc1O)N1CCC(Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HTR2B P41595 1/20 0.54
MAPK14 Q16539 1/20 0.54
SPR P35270 1/20 0.54
MGLL Q99685 4/20 0.51
CHRM2 P08172 1/20 0.51
GRIN2D O15399 2/20 0.48
GRIN3B O60391 2/20 0.48
GRIN1 Q05586 2/20 0.48
GRIN2A Q12879 2/20 0.48
GRIN2B Q13224 2/20 0.48
GRIN2C Q14957 2/20 0.48
GRIN3A Q8TCU5 2/20 0.48
CCR5 P51681 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
SCHEMBL9785745 0.88 CYP2C9 (0.63) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL4151317 0.81 SPR (0.60) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL3792423 0.79 HSP90AA1 (0.51) MGLL
SCHEMBL4151385 0.78 GRIN2D (0.50) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL4159521 0.78 MGLL (0.50) MGLLGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4959434 0.76 ALDH1A1 (0.59) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL4145949 0.76 GRIN2D (0.63) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL2729282 0.76 CYP2C9 (0.60) CYP2C9CYP2C19HTR2BMAPK14SPR
SCHEMBL4155107 0.76 HSP90AA1 (0.50) SPR
SCHEMBL6990112 0.75 CYP2C9 (0.54) CYP2C9CYP2C19HTR2BMAPK14SPR

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-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US claimed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
US-20090215742-A1 AMIDE RESORCINOL COMPOUNDS PFIZER, INC. 2009-08-27 US disclosed
EP-1879863-A1 AMIDE RESORCINOL COMPOUNDS Pfizer, Inc. (US) 2008-01-23 EP disclosed
WO-2006117669-A1 AMIDE RESORCINOL COMPOUNDS PFIZER INC. (US) 2006-11-09 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-20090215742-A1 AMIDE RESORCINOL COMPOUNDS HSP90AB1, HSP90AA1, HSP90AB2P CYP2C9 787/4885CYP2C19 1294/4885HTR2B 4342/4885

“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.