SCHEMBL3078432

SCHEMBL3078432

O=C(c1ccccc1)c1ccc(Cl)cc1NS(=O)(=O)c1ccc(F)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.60
HTT P42858 2/20 0.60
TP53 P04637 1/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.53
BDKRB1 P46663 4/20 0.52
PGR P06401 1/20 0.50
GPR27 Q9NS67 1/20 0.50
CCR9 P51686 2/20 0.49
ACLY P53396 2/20 0.49
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CCR2 P41597 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
CCR4 P51679 1/20 0.47
CCR5 P51681 1/20 0.47

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
SCHEMBL13180354 0.90 LMNA (0.56) LMNAHTTTP53MAPTKMT2A
SCHEMBL3090152 0.89 LMNA (0.70) LMNAHTTTP53MAPTKMT2A
SCHEMBL3083287 0.87 ACLY (0.55) LMNAHTTTP53MAPTKMT2A
SCHEMBL13146456 0.83 CCR2 (0.62) LMNAHTTCCR2
SCHEMBL13146558 0.82 LMNA (0.71) LMNAHTTTP53MAPTKMT2A
SCHEMBL3089394 0.82 ACLY (0.62) LMNAHTTKMT2APGRCCR9
SCHEMBL12221304 0.81 CCR9 (0.66) LMNAHTTBDKRB1CCR9CCR2
SCHEMBL28518 0.81 LMNA (0.80) LMNAHTTTP53MAPTKMT2A
SCHEMBL28006 0.79 LMNA (0.86) LMNAHTTTP53MAPTKMT2A
SCHEMBL2531458 0.79 LMNA (0.69) LMNAHTTTP53MAPTKMT2A

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-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. 2010-09-16 US disclosed
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. 2010-09-16 US disclosed
US-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. 2010-09-16 US disclosed
WO-2008008374-A2 CCR2 INHIBITORS AND METHODS OF USE THEREOF CHEMOCENTRYX, INC. (US) 2008-01-17 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-20100234364-A1 CCR2 INHIBITORS AND METHODS OF USE THEREOF CCR2, CCR9, CCR1 LMNA 4007/4885HTT 3097/4885TP53 4362/4885

“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.