SCHEMBL4650259

SCHEMBL4650259

N#Cc1cccc(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.61
SLC22A12 Q96S37 2/20 0.56
FFAR4 Q5NUL3 2/20 0.55
PGR P06401 1/20 0.53
ATIC P31939 1/20 0.50
CYP19A1 P11511 1/20 0.50
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
AR P10275 1/20 0.46
P4HB P07237 1/20 0.46
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
PKM P14618 1/20 0.45
HPGD P15428 1/20 0.45
TCF4 P15884 1/20 0.45
CTNNB1 P35222 1/20 0.45
ALOX15 P16050 1/20 0.45

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
SCHEMBL7571564 0.84 AR (0.60) SLC22A12FFAR4CYP19A1MAPTSMN1; SMN2
SCHEMBL7589397 0.81 FFAR4 (0.52) GPR119SLC22A12FFAR4MAPT
SCHEMBL14458175 0.81 ALOX15 (0.64) GPR119SLC22A12FFAR4PGRCYP19A1
SCHEMBL26536748 0.81 HSD17B2 (0.62) GPR119SLC22A12FFAR4CYP19A1MAPT
SCHEMBL31681329 0.81 FFAR4 (0.65) GPR119SLC22A12FFAR4CYP19A1MAPT
SCHEMBL11028156 0.80 PGR (0.64) GPR119SLC22A12PGRATICCYP19A1
SCHEMBL7572608 0.80 KMT2A (0.61) FFAR4PGRMAPTSMN1; SMN2HDAC1
SCHEMBL27871885 0.79 HTR6 (0.68) SLC22A12PGRATICCYP19A1P4HB
SCHEMBL4650279 0.78 UQCRB (0.65) SLC22A12FFAR4ATICMAPTSMN1; SMN2
SCHEMBL28561814 0.78 FFAR4 (0.61) GPR119FFAR4CYP19A1MAPTSMN1; SMN2

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
US-20080275114-A1 Inhibitors of Ccr9 Activity NOVARTIS AG (CH) 2008-11-06 US claimed
EP-1966131-A1 INHIBITORS OF CCR9 ACTIVITY Novartis Pharma AG (CH) 2008-09-10 EP claimed
WO-2007071443-A1 INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2007-06-28 WO claimed
US-20080275114-A1 Inhibitors of Ccr9 Activity NOVARTIS AG (CH) 2008-11-06 US disclosed
EP-1966131-A1 INHIBITORS OF CCR9 ACTIVITY Novartis Pharma AG (CH) 2008-09-10 EP disclosed
EP-1966132-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-09-10 EP disclosed
WO-2007071443-A1 INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2007-06-28 WO disclosed
WO-2007070760-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-21 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-20080275114-A1 Inhibitors of Ccr9 Activity CCR9, CCR1, CCR4 GPR119 63/4885SLC22A12 2675/4885FFAR4 1035/4885

“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.