SCHEMBL2232088

SCHEMBL2232088

O=C(O)c1cc(-c2cccc(F)c2F)cc(-n2cnnn2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 1/20 0.43
KMT2A Q03164 6/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 1/20 0.40
NOTUM Q6P988 2/20 0.40
LMNA P02545 1/20 0.40
KCNJ1 P48048 1/20 0.38

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
SCHEMBL2202932 0.90 SMN1; SMN2 (0.47) SMN1; SMN2TP53KMT2ARAB9ANPC1
SCHEMBL357809 0.82 TTR (0.44) SMN1; SMN2TP53KMT2ARAB9ANPC1
SCHEMBL15327654 0.81 SMN1; SMN2 (0.48) SMN1; SMN2TP53KMT2ARAB9AMEN1
SCHEMBL2200779 0.81 KMT2A (0.46) SMN1; SMN2TP53KMT2AMEN1ALDH1A1
SCHEMBL2208219 0.81 KMT2A (0.47) SMN1; SMN2TP53KMT2ARAB9AMEN1
SCHEMBL2205960 0.81 SMN1; SMN2 (0.47) SMN1; SMN2TP53KMT2ARAB9AMEN1
SCHEMBL358004 0.80 NOTUM (0.43) SMN1; SMN2TP53KMT2AALDH1A1NOTUM
SCHEMBL356937 0.80 NOTUM (0.43) SMN1; SMN2KMT2AMEN1NOTUM
SCHEMBL4321362 0.80 SMN1; SMN2 (0.44) SMN1; SMN2TP53KMT2ARAB9AMEN1
SCHEMBL4324303 0.79 SMN1; SMN2 (0.53) SMN1; SMN2TP53KMT2ARAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2205573-B1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2013-10-23 EP claimed
EP-2205573-B1 TETRAZOLE-SUBSTITUTED ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2013-10-23 EP disclosed
US-7981914-B2 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2011-07-19 US disclosed
US-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 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 (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-20090093523-A1 Tetrazole-substituted aryl amide derivatives and uses thereof AR, NAT1, TBXA2R SMN1; SMN2 1615/4885TP53 3030/4885KMT2A 1756/4885

“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.