SCHEMBL19686697

SCHEMBL19686697

Cc1cc(C)n(-c2nc(N3CCOCC3)cc(N(O)C3CCC(F)(F)CC3)n2)n1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 10/20 0.52
ADORA1 P30542 9/20 0.52
SMN1; SMN2 Q16637 3/20 0.46
ALOX15 P16050 3/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.42
EGFR P00533 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.39
NPSR1 Q6W5P4 1/20 0.36
HRH4 Q9H3N8 1/20 0.36

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
SCHEMBL31127232 0.79 ADORA2A (0.51) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19687121 0.79 ADORA2A (0.51) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19686815 0.79 ADORA2A (0.61) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19687387 0.78 ALOX15 (0.44) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL4213091 0.74 KMT2A (0.70) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19687333 0.73 SMN1; SMN2 (0.53) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL31127394 0.73 EGFR (0.57) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19686450 0.73 SMN1; SMN2 (0.50) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19687078 0.73 EGFR (0.57) ADORA2AADORA1SMN1; SMN2ALOX15LMNA
SCHEMBL19687045 0.73 ADORA2A (0.63) ADORA2AADORA1SMN1; SMN2ALOX15LMNA

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
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 US disclosed
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2019-07-18 US disclosed
WO-2017139697-A9 BACTERIA ENGINEERED TO TREAT DISEASES ASSOCIATED WITH HYPERAMMONEMIA SYNLOGIC, INC. (US) 2017-12-07 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 (2 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 ADORA2A 1711/4885ADORA1 1011/4885SMN1; SMN2 1109/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 ADORA2A 1711/4885ADORA1 1011/4885SMN1; SMN2 1109/4885

“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.