SCHEMBL25487698

SCHEMBL25487698

CNC(C)C(=O)Nc1c(C)sc2ccc3nc(C)ccc3c12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BIRC2 Q13490 15/20 0.41
XIAP P98170 14/20 0.41
P2RX7 Q99572 1/20 0.39
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL25487700 0.84 GLS (0.39) P2RX7NPC1RAB9A
SCHEMBL25487707 0.84 GLS (0.39) P2RX7NPC1RAB9A
SCHEMBL25487531 0.77 NR3C1 (0.37) P2RX7
SCHEMBL25487994 0.75 P2RX7 (0.35) P2RX7SMN1; SMN2
SCHEMBL25487525 0.73 P2RX7 (0.36) P2RX7
SCHEMBL25487830 0.72 LIMK1 (0.35) P2RX7LMNAMAPTHTTSMN1; SMN2
SCHEMBL25487882 0.72 P2RX7 (0.36) P2RX7SMN1; SMN2
SCHEMBL25490145 0.71 KDM4E (0.37) P2RX7LMNAMAPTHTTNPC1
SCHEMBL25487709 0.70 MEN1 (0.36) P2RX7NPC1RAB9A
SCHEMBL25487572 0.70 ALDH1A1 (0.36) LMNAMAPTSMN1; SMN2NPC1RAB9A

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-11655257-B2 MK2 inhibitors, synthesis thereof, and intermediates thereto CELGENE CAR LLC (BM) 2023-05-23 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-11655257-B2 MK2 inhibitors, synthesis thereof, and intermediates thereto WEE2, WEE1, CDK2 BIRC2 1290/4885XIAP 793/4885P2RX7 3185/4885

“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.