SCHEMBL22307824

SCHEMBL22307824

CCCCCCC(CCCCCC)Cc1ncncn1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.41
▸ SLC2A1 P11166 1/20 0.35
▸ PRSS1 P07477 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ GGPS1 O95749 2/20 0.32
▸ CSNK1E P49674 1/20 0.32
▸ ADA P00813 1/20 0.31
▸ KDR P35968 1/20 0.31

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
SCHEMBL22308475 1.00 LMNA (0.41) LMNASLC2A1PRSS1PRSS2PRSS3
SCHEMBL22308297 0.83 LMNA (0.42) LMNASLC2A1PRSS1PRSS2PRSS3
SCHEMBL20901211 0.76 FAAH (0.39) LMNASLC2A1PRSS1PRSS2PRSS3
SCHEMBL19963496 0.75 LMNA (0.38) LMNASLC2A1PRSS1PRSS2PRSS3
SCHEMBL20499801 0.74 KCNH2 (0.42) LMNA
SCHEMBL28091635 0.74 KCNH2 (0.42) LMNA
SCHEMBL28254738 0.74 KCNH2 (0.42) LMNA
SCHEMBL20747030 0.74 KCNH2 (0.42) LMNA
SCHEMBL27794520 0.74 KCNH2 (0.42) LMNA
SCHEMBL22307857 0.73 NR1I2 (0.36) LMNASLC2A1ADAKDR

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-11358940-B2 K-Ras modulators THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-06-14 — — US disclosed
US-20200247762-A1 K-RAS MODULATORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-08-06 — — 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-20200247762-A1 K-RAS MODULATORS KRAS, HRAS, NRAS LMNA 4191/4885SLC2A1 3742/4885PRSS1 1598/4885
US-11358940-B2 K-Ras modulators KRAS, HRAS, NRAS LMNA 4093/4885SLC2A1 3566/4885PRSS1 2288/4885

“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.

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