SCHEMBL3088122

SCHEMBL3088122

O=C(c1ccccc1)c1ccccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.62
▸ MEN1 O00255 3/20 0.62
▸ LMNA P02545 2/20 0.62
▸ BDKRB1 P46663 6/20 0.60
▸ ACLY P53396 1/20 0.59
▸ HTT P42858 1/20 0.58
▸ SLC25A1 P53007 1/20 0.58
▸ PTGES2 Q9H7Z7 1/20 0.56
▸ CCR2 P41597 4/20 0.56
▸ CYP1A2 P05177 3/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ CYP2D6 P10635 2/20 0.56
▸ CYP2C9 P11712 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ CCR4 P51679 2/20 0.56
▸ CCR5 P51681 2/20 0.56
▸ KCNH2 Q12809 1/20 0.56
▸ KDM4E B2RXH2 2/20 0.55
▸ TSHR P16473 1/20 0.55
▸ PTK2B Q14289 1/20 0.55

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
SCHEMBL2530071 0.89 LMNA (0.74) KMT2ALMNAACLYHTTCCR2
SCHEMBL34475240 0.88 MEN1 (0.78) KMT2AMEN1LMNAACLYSLC25A1
SCHEMBL13146484 0.88 LMNA (0.60) KMT2AMEN1LMNABDKRB1ACLY
SCHEMBL13146485 0.87 ACLY (0.60) KMT2AMEN1LMNABDKRB1ACLY
SCHEMBL10223155 0.86 CCR2 (0.63) KMT2AMEN1LMNABDKRB1ACLY
SCHEMBL2534648 0.85 BDKRB1 (0.73) KMT2AMEN1LMNABDKRB1HTT
SCHEMBL31305 0.83 BDKRB1 (0.72) KMT2AMEN1LMNABDKRB1HTT
SCHEMBL10223159 0.82 CCR2 (0.59) KMT2AMEN1LMNAACLYPTGES2
SCHEMBL643467 0.82 LMNA (0.66) KMT2AMEN1LMNAACLYHTT
SCHEMBL13146596 0.81 MEN1 (0.54) KMT2AMEN1LMNAACLYHTT

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
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
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 KMT2A 2576/4885MEN1 4867/4885LMNA 4007/4885

“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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