SCHEMBL4924236

SCHEMBL4924236

CCOC(=O)c1cc(-c2ccc(Cl)cc2Cl)n(-c2ccc([Si](C)(C)C)cc2)c1C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.57
▸ CHRNA7 P36544 9/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPT P10636 4/20 0.44
▸ NPC1 O15118 2/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CNR1 P21554 2/20 0.44
▸ CNR2 P34972 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ OPRL1 P41146 1/20 0.41

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
SCHEMBL4492901 0.91 MAPK1 (0.67) MAPK1CHRNA7SMN1; SMN2KDM4EMAPT
SCHEMBL4918783 0.88 MAPK1 (0.60) MAPK1CHRNA7SMN1; SMN2KDM4EMAPT
SCHEMBL6071579 0.87 CHRNA7 (0.63) MAPK1CHRNA7SMN1; SMN2MAPTNPC1
SCHEMBL5922316 0.86 CHRNA7 (0.58) MAPK1CHRNA7KDM4EMAPTRAB9A
SCHEMBL14270596 0.82 CNR1 (0.53) MAPK1CHRNA7SMN1; SMN2KDM4EMAPT
SCHEMBL4918803 0.77 CNR1 (0.60) CNR1CNR2
SCHEMBL16403251 0.77 CHRNA7 (0.81) MAPK1CHRNA7MAPTALDH1A1LMNA
SCHEMBL4465707 0.76 NOTUM (0.63) MAPK1CHRNA7SMN1; SMN2TSHRCNR1
SCHEMBL5922363 0.75 MAPK1 (0.60) MAPK1CHRNA7SMN1; SMN2KDM4EMAPT
SCHEMBL4474686 0.75 CHRNA7 (0.62) CHRNA7CNR1CNR2ALDH1A1OPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008151389-A1 CHEMICALLY MODIFIED MACROMOLECULES MACFARLANE BURNET INSTITUTE FOR MEDICAL RESEARCH AND PUBLIC HEALTH LIMITED (AU) 2008-12-18 — — WO disclosed
US-20080051433-A1 Pyrrole-3-Carboxamide Derivatives for the Treatment of Obesity ASTRAZENECA (SE) 2008-02-28 — — US disclosed
US-20080051433-A1 Pyrrole-3-Carboxamide Derivatives for the Treatment of Obesity ASTRAZENECA (SE) 2008-02-28 — — US disclosed
EP-1718610-A1 PYRROLE-3-CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF OBESITY AstraZeneca AB (SE) 2006-11-08 — — EP disclosed
WO-2005080328-A1 PYRROLE-3-CARBOXAMIDE DERIVATIVES FOR THE TREATMENT OF OBESITY ASTRAZENECA AB (SE) 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-20080051433-A1 Pyrrole-3-Carboxamide Derivatives for the Treatment of Obesity PC, GPR119, PGC MAPK1 3403/4885CHRNA7 590/4885SMN1; SMN2 1404/4885

“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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