SCHEMBL6011932

SCHEMBL6011932

CS(=O)(=O)C(=C1CN(C(c2ccc(Cl)cc2)c2ccc([C@H](CO)N3CCCC3)cc2)C1)c1cc(F)cc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 8/20 0.42
LMNA P02545 4/20 0.37
THRB P10828 2/20 0.37
POLB P06746 1/20 0.35
MC4R P32245 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
P2RX7 Q99572 2/20 0.33
GPX4 P36969 1/20 0.33
SLC6A9 P48067 1/20 0.33

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
SCHEMBL6011595 1.00 TP53 (0.42) TP53LMNATHRBPOLBMC4R
SCHEMBL6011592 1.00 TP53 (0.42) TP53LMNATHRBPOLBMC4R
SCHEMBL6794152 1.00 TP53 (0.42) TP53LMNATHRBPOLBMC4R
SCHEMBL6011842 0.90 TP53 (0.40) TP53LMNATHRBPOLBMC4R
SCHEMBL6011838 0.90 TP53 (0.40) TP53LMNATHRBPOLBMC4R
SCHEMBL6929612 0.90 TP53 (0.40) TP53LMNATHRBPOLBMC4R
SCHEMBL674830 0.88 CYP2D6 (0.38) OPRM1OPRD1GPX4SLC6A9
SCHEMBL5077602 0.86 KDM4E (0.40) LMNAOPRM1
SCHEMBL5077620 0.86 KDM4E (0.40) LMNAOPRM1
SCHEMBL5077604 0.86 KDM4E (0.40) LMNAOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060270649-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM AVENTIS PHARMA S.A. (FR) 2006-11-30 US disclosed
US-6858603-B2 Acetindine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2005-02-22 US disclosed
US-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2004-11-25 US disclosed
US-20030162808-A1 Acetindine derivatives, their preparation and medicaments containing them AVENTIS PHARMA S.A. (FR) 2003-08-28 US 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 (3 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-20040235816-A1 Azetidine derivatives, their preparation and medicaments containing them AZI2, ADRA2A, ADRA2C TP53 3016/4885LMNA 3302/4885THRB 3686/4885
US-20060270649-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM AZI2, QDPR, ADRA2A TP53 3113/4885LMNA 3203/4885THRB 3724/4885
US-20030162808-A1 Acetindine derivatives, their preparation and medicaments containing them ADRA1D, ADRB2, AZI2 TP53 3771/4885LMNA 3266/4885THRB 3910/4885

“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.