SCHEMBL23384253

SCHEMBL23384253

CCN1CCC(N2CCN(C3CCN(C(C)C)CC3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HRH3 Q9Y5N1 3/20 0.35
ACHE P22303 3/20 0.35
TSHR P16473 1/20 0.35
TLR9 Q9NR96 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
CHRM4 P08173 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33

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
SCHEMBL22828510 0.96 KMT2A (0.44) KMT2AL3MBTL1HRH3ACHETSHR
SCHEMBL11919044 0.96 KMT2A (0.47) KMT2ASMN1; SMN2HRH3ACHETSHR
SCHEMBL23384251 0.94 KMT2A (0.43) KMT2AL3MBTL1HRH3ACHETSHR
SCHEMBL25123775 0.89 KMT2A (0.40) KMT2AL3MBTL1HRH3ACHETLR9
SCHEMBL12325469 0.85 KMT2A (0.39) KMT2ASMN1; SMN2HRH3TSHR
SCHEMBL11919058 0.83 KMT2A (0.56) KMT2ASMN1; SMN2ACHECHRM4OPRM1
SCHEMBL22456342 0.83 HRH3 (0.41) L3MBTL1HRH3TSHRTLR9TLR8
SCHEMBL14453902 0.83 HRH3 (0.41) L3MBTL1HRH3TSHRTLR9TLR8
SCHEMBL11919045 0.83 KMT2A (0.56) KMT2ASMN1; SMN2ACHECHRM4
SCHEMBL26171322 0.83 PIK3CD (0.36) KMT2AHRH3TLR9TLR8TLR7

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-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-05-20 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-20210147385-A1 COMPOUNDS AND METHODS FOR TARGETING PATHOGENIC BLOOD VESSELS TEK, KDR, LIPG KMT2A 4795/4885SMN1; SMN2 1703/4885L3MBTL1 2745/4885

“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.