SCHEMBL26653202

SCHEMBL26653202

C=Cc1c(CC)n(-c2ccc(F)c(C)c2)c2ccc(C)cc12

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
NOD2 Q9HC29 1/20 0.32
GPR55 Q9Y2T6 1/20 0.32
RXRA P19793 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL23898528 0.80 NPC1 (0.48) MEN1RAB9AKMT2ATP53MAPT
SCHEMBL30335604 0.72 KCNH2 (0.33)
SCHEMBL23883765 0.72 KCNH2 (0.33)
SCHEMBL8116674 0.68 POLB (0.38) MEN1POLBRAB9AKMT2ATP53
SCHEMBL22067602 0.68 PTGS2 (0.38) MEN1USP2POLBRAB9AKMT2A
SCHEMBL26652936 0.68 RXRA (0.31) RXRAGRIN1GRIN2B
SCHEMBL21279671 0.67 TP53 (0.38) MEN1USP2POLBRAB9AKMT2A
SCHEMBL19622066 0.66 KDM4E (0.43) MEN1POLBKMT2AMAPT
SCHEMBL23898695 0.66 MEN1 (0.47) MEN1RAB9AKMT2AMAPT
SCHEMBL14613214 0.65 MEN1 (0.55) MEN1USP2POLBRAB9AKMT2A

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-20230339915-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN VERTEX PHARMACEUTICALS INCORPORATED 2023-10-26 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-20230339915-A1 MODULATORS OF ALPHA-1 ANTITRYPSIN SERPINA2, SERPINA3, SERPINB1 MEN1 1904/4885USP2 3339/4885POLB 673/4885

“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.