SCHEMBL2593923

SCHEMBL2593923

c1ccc(C(c2ccccc2)n2ccc3ncccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.50
RPS6KA5 O75582 6/20 0.47
MET P08581 5/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP19A1 P11511 3/20 0.40
RPS6KA4 O75676 2/20 0.39
CDC7 O00311 1/20 0.39
CDK2 P24941 1/20 0.39
MGLL Q99685 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
SCHEMBL17889739 0.83 RPS6KA5 (0.45) P2RX7RPS6KA5METMEN1HPGD
SCHEMBL3225487 0.77 SLC6A2 (0.43) P2RX7RPS6KA5METMEN1HPGD
SCHEMBL3227906 0.77 SLC6A2 (0.43) P2RX7RPS6KA5METMEN1HPGD
SCHEMBL5865198 0.77 MEN1 (0.69) P2RX7MEN1HPGDKMT2AHSD17B10
SCHEMBL28575649 0.77 RPS6KA5 (0.52) RPS6KA5METRPS6KA4CDC7CDK2
SCHEMBL4546571 0.77 RPS6KA5 (0.52) RPS6KA5METMEN1HPGDKMT2A
SCHEMBL3218825 0.74 SLC6A2 (0.66)
SCHEMBL3225255 0.74 SLC6A2 (0.66)
SCHEMBL22930553 0.74 RPS6KA5 (0.49) RPS6KA5METMEN1HPGDKMT2A
SCHEMBL2586507 0.72 P2RX7 (0.50) P2RX7CYP19A1CDC7CDK2MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269788-A1 SPIRO-OXINDOLE-DERIVATIVES AS SODIUM CHANNEL BLOCKERS XENON PHARMACEUTICALS INC. (CA) 2011-11-03 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-20110269788-A1 SPIRO-OXINDOLE-DERIVATIVES AS SODIUM CHANNEL BLOCKERS SCN3A, SCN1B, SCN2B P2RX7 600/4885RPS6KA5 2498/4885MET 4340/4885

“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.