SCHEMBL614725

SCHEMBL614725

O=C(O)[C@@H]1CCCN1C(=O)COc1ccc(Nc2nc3ccc(-c4cc(O)ccc4Cl)cn3n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.43
BTK Q06187 1/20 0.43
SRC P12931 3/20 0.39
YES1 P07947 2/20 0.39
PDGFRB P09619 2/20 0.39
CIT O14578 1/20 0.39
GAK O14976 1/20 0.39
EPHB6 O15197 1/20 0.39
RIPK2 O43353 1/20 0.39
PRKD3 O94806 1/20 0.39
ABL1 P00519 1/20 0.39
LCK P06239 1/20 0.39
RET P07949 1/20 0.39
BCR P11274 1/20 0.39
BRAF P15056 1/20 0.39
EPHA2 P29317 1/20 0.39
EPHB2 P29323 1/20 0.39
TYK2 P29597 1/20 0.39
KDR P35968 1/20 0.39
ACVR1B P36896 1/20 0.39

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
SCHEMBL614726 1.00 JAK3 (0.43) JAK3BTKSRCYES1PDGFRB
SCHEMBL614357 0.82 SYK (0.43) SRCYES1PDGFRBCITGAK
SCHEMBL612998 0.81 TTK (0.39) SRCYES1PDGFRBCITGAK
SCHEMBL612999 0.81 TTK (0.39) SRCYES1PDGFRBCITGAK
SCHEMBL612376 0.79 SRC (0.46) JAK3SRCYES1PDGFRBCIT
SCHEMBL615192 0.78 LRRK2 (0.48) SRCYES1PDGFRBCITGAK
SCHEMBL613040 0.78 LRRK2 (0.52) JAK3SRCYES1PDGFRBCIT
SCHEMBL613798 0.75 ESR1 (0.45) SRCYES1PDGFRBCITGAK
SCHEMBL615134 0.75 SRC (0.53) JAK3SRCYES1PDGFRBCIT
SCHEMBL45534 0.75 SRC (0.45) JAK3SRCYES1PDGFRBCIT

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-20120041195-A1 Heterocyclic compounds FOVEA PHARMACEUTICALS 2012-02-16 US claimed
US-20120041195-A1 Heterocyclic compounds FOVEA PHARMACEUTICALS 2012-02-16 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-20120041195-A1 Heterocyclic compounds MAP3K1, MAP3K5, MAP3K2 JAK3 335/4885BTK 424/4885SRC 1204/4885

“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.