SCHEMBL24177609

SCHEMBL24177609

CNCCCCC(NC)C(=O)C1CCCCCCCCC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 1/20 0.41
▸ NAAA Q02083 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ EPHX1 P07099 9/20 0.33
▸ ITGB3 P05106 2/20 0.32
▸ ITGA2B P08514 2/20 0.32
▸ EPHX2 P34913 2/20 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
SCHEMBL18056091 0.84 ITGB3 (0.43) ITGB3ITGA2B
SCHEMBL24860034 0.83 NAAA (0.40) NAAASMN1; SMN2KEAP1NFE2L2EPHX1
SCHEMBL23085465 0.78 NAAA (0.38) NAAASMN1; SMN2EPHX1
SCHEMBL22986172 0.74 EPHX1 (0.40) NAAASMN1; SMN2EPHX1
SCHEMBL22054572 0.74 SMN1; SMN2 (0.45) SIGMAR1SMN1; SMN2EPHX1EPHX2
SCHEMBL25573548 0.74 SMN1; SMN2 (0.45) SIGMAR1SMN1; SMN2EPHX1EPHX2
SCHEMBL14525109 0.72 KISS1R (0.47) SMN1; SMN2EPHX1
SCHEMBL13057114 0.72 CPB2 (0.43) SMN1; SMN2EPHX1
SCHEMBL19401625 0.72 CPB2 (0.43) SMN1; SMN2EPHX1
SCHEMBL9976417 0.72 KISS1R (0.47) SMN1; SMN2EPHX1

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-20220001022-A1 Immunoconjugates Targeting HER2 BOLT BIOTHERAPEUTICS, INC. (US) 2022-01-06 — — 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 (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-20220001022-A1 Immunoconjugates Targeting HER2 ERBB2, EGFR, FCGR2A SIGMAR1 1616/4885NAAA 3766/4885SMN1; SMN2 4376/4885

“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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