SCHEMBL1677378

SCHEMBL1677378

N#Cc1ccc(N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1N

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.50
BCL2 P10415 6/20 0.50
BAK1 Q16611 4/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.47
LMNA P02545 1/20 0.47
BCL2L1 Q07817 3/20 0.47
CNR1 P21554 1/20 0.45
ADORA1 P30542 1/20 0.44
DRD4 P21917 1/20 0.43

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
SCHEMBL1114168 0.89 HTR7 (0.46) HTR7KDM4EALDH1A1GAAMAPT
SCHEMBL12806160 0.85 BCL2 (0.50) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL10058377 0.83 BCL2 (0.51) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL376898 0.82 HTR7 (0.60) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL1540748 0.79 KMT2A (0.56) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL15938164 0.78 HTR7 (0.81) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL19145578 0.76 HTR7 (0.81) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL1540287 0.76 BCL2 (0.60) HTR7BCL2BAK1KDM4EALDH1A1
SCHEMBL1114104 0.75 BCL2 (0.49) HTR7BCL2BAK1BCL2L1
SCHEMBL1677443 0.75 BCL2 (0.49) HTR7BCL2BAK1BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2094672-B1 ARYLSULFONAMIDE COMPOUNDS GENENTECH INC (US) 2013-05-29 EP disclosed
US-8168645-B2 Arylsulfonamide compounds GENENTECH, INC. (US) 2012-05-01 US disclosed
US-8168645-B2 Arylsulfonamide compounds GENENTECH, INC. (US) 2012-05-01 US disclosed
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAELL JONATHAN BAYLDON 2011-04-28 US disclosed
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAELL JONATHAN BAYLDON 2011-04-28 US disclosed
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAELL JONATHAN BAYLDON 2011-04-28 US disclosed
US-20100056517-A1 ARYLSULFONAMIDE COMPOUNDS GENENTECH, INC. (US) 2010-03-04 US disclosed
US-20100056517-A1 ARYLSULFONAMIDE COMPOUNDS GENENTECH, INC. (US) 2010-03-04 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-20100056517-A1 ARYLSULFONAMIDE COMPOUNDS BCL2A1, BCL2, BAX HTR7 3893/4885BCL2 2/4885BAK1 7/4885
US-20110098305-A1 ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE BAX, API5, BCL2 HTR7 2134/4885BCL2 3/4885BAK1 8/4885

“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.