SCHEMBL2055421

SCHEMBL2055421

O=S(=O)(Nc1ccc2ncccc2c1)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.68
LMNA P02545 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
CYP3A4 P08684 7/20 0.61
CYP2D6 P10635 5/20 0.53
PSEN1 P49768 4/20 0.53
PSEN2 P49810 4/20 0.53
APH1B Q8WW43 4/20 0.53
NCSTN Q92542 4/20 0.53
APH1A Q96BI3 4/20 0.53
PSENEN Q9NZ42 4/20 0.53
HTR6 P50406 1/20 0.52
SLC40A1 Q9NP59 2/20 0.51
NPC1 O15118 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
PFKFB3 Q16875 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
PGR P06401 1/20 0.49

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
SCHEMBL6980375 0.90 LMNA (0.65) ALDH1A1LMNASMN1; SMN2HTR6SLC40A1
SCHEMBL6981076 0.89 ALDH1A1 (0.76) ALDH1A1LMNASMN1; SMN2SLC40A1MEN1
SCHEMBL2055443 0.89 CYP3A4 (0.61) ALDH1A1LMNASMN1; SMN2CYP3A4CYP2D6
SCHEMBL6985862 0.85 ALDH1A1 (0.78) ALDH1A1LMNASMN1; SMN2SLC40A1NPC1
SCHEMBL2055424 0.83 CYP3A4 (0.59) ALDH1A1LMNASMN1; SMN2CYP3A4CYP2D6
SCHEMBL2055422 0.82 ALPL (0.67) ALDH1A1LMNASMN1; SMN2CYP3A4MEN1
SCHEMBL6979083 0.82 SMN1; SMN2 (0.74) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6978003 0.81 ALDH1A1 (0.76) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6978649 0.81 ALDH1A1 (1.00) ALDH1A1LMNASMN1; SMN2SLC40A1NPC1
SCHEMBL6982196 0.81 ALDH1A1 (0.76) ALDH1A1LMNASMN1; SMN2NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 US disclosed
WO-2009030715-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-03-12 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-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS ARSA, SULT2A1, PMM2 ALDH1A1 468/4885LMNA 2804/4885SMN1; SMN2 2062/4885

“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.