SCHEMBL2188799

SCHEMBL2188799

O=C1CCC(=NO)C(c2ccc(Br)cc2)N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
LMNA P02545 3/20 0.35
MAPT P10636 4/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
KDM1A O60341 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
LIG1 P18858 1/20 0.33
NPC1 O15118 2/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL2188794 1.00 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL6099657 0.84 TP53 (0.40) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL6099660 0.84 TP53 (0.40) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7911512 0.83 DDB1 (0.38) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7911514 0.83 DDB1 (0.38) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL8529904 0.82 KMT2A (0.44) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL8534824 0.82 KMT2A (0.44) ALDH1A1MEN1KMT2ALMNAKDM4E
SCHEMBL8613935 0.80 ESR1 (0.40) ALDH1A1MEN1KMT2AMAPTKDM1A
SCHEMBL8530171 0.80 DDB1 (0.44) SMN1; SMN2ALDH1A1MAPTKDM4EHPGD
SCHEMBL8530344 0.80 TP53 (0.38) SMN1; SMN2MEN1KMT2AHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2361246-A1 OXOPIPERIDINYL AND PYRANYL SULFONAMIDES AS AMPA POTENTIATORS Pfizer Inc. (US) 2011-08-31 EP disclosed
US-20110172297-A1 Oxopiperdinyl And Pyranyl Sulfonamides and Pharmaceutical Compositions Thereof PFIZER INC 2011-07-14 US disclosed
WO-2010038167-A1 OXOPIPERIDINYL AND PYRANYL SULFONAMIDES AS AMPA POTENTIATORS PFIZER INC. (US) 2010-04-08 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-20110172297-A1 Oxopiperdinyl And Pyranyl Sulfonamides and Pharmaceutical Compositions Thereof GRIK5, GABRE, GRIK2 SMN1; SMN2 2115/4885ALDH1A1 1118/4885MEN1 3722/4885

“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.