SCHEMBL975158

SCHEMBL975158

CC(C)[C@H](NC(=O)c1cc(NS(=O)(=O)CC2CN(C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)C2)cc(C(F)(F)F)c1)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CLPP Q16740 1/20 0.39
RHOC P08134 5/20 0.38
RHOA P61586 5/20 0.38
CCR1 P32246 5/20 0.36
UTS2R Q9UKP6 1/20 0.35
CCR2 P41597 1/20 0.35
ELANE P08246 3/20 0.35
DDR1 Q08345 2/20 0.34
RORC P51449 1/20 0.34

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
SCHEMBL976736 0.92 CCR2 (0.39) CLPPRHOCRHOAUTS2RCCR2
SCHEMBL976507 0.90 CCR1 (0.36) CCR1
SCHEMBL975369 0.90 CCR1 (0.38) CCR1
SCHEMBL976415 0.89 RHOC (0.36) CLPPRHOCRHOACCR1UTS2R
SCHEMBL976069 0.89 RHOC (0.36) CLPPRHOCRHOAUTS2RCCR2
SCHEMBL974820 0.89 CCR1 (0.36) CCR1
SCHEMBL978434 0.88 CCR1 (0.34) CCR1DDR1
SCHEMBL976319 0.88 CCR2 (0.42) CLPPRHOCRHOAUTS2RCCR2
SCHEMBL975645 0.86 TRPA1 (0.35) CCR1
SCHEMBL977002 0.86 RHOC (0.43) RHOCRHOACCR2DDR1

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
EP-2234966-B1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI SA (FR) 2013-09-11 EP claimed
US-8445478-B2 Azetidine derivatives, their preparation and their application in therapy SANOFI (FR) 2013-05-21 US claimed
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2011-01-13 US claimed
US-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI (FR) 2013-09-12 US disclosed
US-8445478-B2 Azetidine derivatives, their preparation and their application in therapy SANOFI (FR) 2013-05-21 US disclosed
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY SANOFI-AVENTIS (FR) 2011-01-13 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 (2 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-20130237513-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B CLPP 3076/4885RHOC 233/4885RHOA 576/4885
US-20110009377-A1 AZETIDINE DERIVATIVES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPY QDPR, AZI2, ADRA1B CLPP 3076/4885RHOC 233/4885RHOA 576/4885

“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.