SCHEMBL21165950

SCHEMBL21165950

COc1cc(NC2CCC2)nc(-c2nc(C)cs2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 3/20 0.39
PDGFRA P16234 3/20 0.39
LMNA P02545 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
JAK2 O60674 2/20 0.35
JAK1 P23458 2/20 0.35
JAK3 P52333 2/20 0.35
KCNN2 Q9H2S1 1/20 0.34
KCNN3 Q9UGI6 1/20 0.34
NUDT1 P36639 1/20 0.34
ALDH1A1 P00352 3/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34

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
SCHEMBL21165930 0.98 PDGFRB (0.41) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL21165967 0.96 LMNA (0.43) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL19686438 0.91 ADORA2A (0.33) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL21165924 0.90 FYN (0.37) KDM4ESMN1; SMN2ADORA2AADORA1IRAK4
SCHEMBL21165976 0.90 PDGFRB (0.33) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL21165941 0.89 ADORA2A (0.33) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL21143995 0.89 IDH1 (0.36) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL31127167 0.89 IDH1 (0.36) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL19687360 0.89 IDH1 (0.36) PDGFRBPDGFRALMNAMEN1KMT2A
SCHEMBL19687359 0.88 GRM5 (0.36) PDGFRBPDGFRALMNAMEN1KMT2A

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 2 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

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 PDGFRB 3314/4885PDGFRA 2514/4885LMNA 1529/4885
US-20190218200-A1 POTASSIUM CHANNEL MODULATORS KCNJ11, KCNJ2, KCNJ1 PDGFRB 3314/4885PDGFRA 2514/4885LMNA 1529/4885

“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.