SCHEMBL3196609

SCHEMBL3196609

CN(Cc1ccccc1)S(=O)(=O)NC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MMP3 P08254 1/20 0.48
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HTT P42858 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.44
ADRB2 P07550 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL7085689 0.84 CA2 (0.55) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL7082389 0.83 MMP3 (0.50) NPC1RAB9AMMP3KMT2AMEN1
SCHEMBL13940771 0.81 CA12 (0.59) NPC1RAB9ACA12ALDH1A1
SCHEMBL2171015 0.80 ALDH1A1 (0.49) NPC1RAB9AMMP3KMT2AMEN1
SCHEMBL17784998 0.80 TSHR (0.57) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL12770117 0.76 ALDH1A1 (0.45) NPC1RAB9AMMP3KMT2AMEN1
SCHEMBL5655809 0.76 ALDH1A1 (0.52) NPC1RAB9AMMP3KMT2AMEN1
SCHEMBL11673475 0.74 HPGD (0.62) KMT2AMEN1CA12CA9ALDH1A1
SCHEMBL7475586 0.74 MMP3 (0.60) NPC1RAB9AMMP3KMT2AMEN1
SCHEMBL4876765 0.74 KMT2A (0.52) NPC1RAB9AMMP3KMT2AMEN1

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-8207186-B2 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase MET MERCK SHARP & DOHME CORP. (US) 2012-06-26 US disclosed
US-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
US-20090197908-A1 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase met MERCK SHARP & DOHME LLC 2009-08-06 US disclosed
US-7550478-B2 Tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 US disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
US-20060293358-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2006-12-28 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 (5 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 NPC1 1683/4885RAB9A 3599/4885MMP3 199/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 NPC1 1377/4885RAB9A 3729/4885MMP3 412/4885
US-20060293358-A1 Tyrosine kinase inhibitors ABL1, ERBB2, RET NPC1 3514/4885RAB9A 3161/4885MMP3 3179/4885
US-20090197908-A1 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase met MET, RET, ERBB2 NPC1 1512/4885RAB9A 2745/4885MMP3 3193/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 NPC1 1683/4885RAB9A 3599/4885MMP3 199/4885

“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.