SCHEMBL29323653

SCHEMBL29323653

CCNC(=O)CCOCCOCCC(=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.40
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
MCL1 Q07820 1/20 0.33
HPGD P15428 1/20 0.33
CAPN1 P07384 2/20 0.33
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.30
MPO P05164 1/20 0.30
MTNR1A P48039 2/20 0.30
MTNR1B P49286 2/20 0.30
TLR2 O60603 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
SCHEMBL23386933 0.86 MEN1 (0.50) KMT2AMEN1TSHRHPGDALDH1A1
SCHEMBL26412077 0.84 MEN1 (0.47) KMT2AMEN1TSHRHPGDALDH1A1
SCHEMBL18751712 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL18751714 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL18751713 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL18751715 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL18751718 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL18751710 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL25818821 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1
SCHEMBL26382110 0.82 MEN1 (0.40) KMT2AMEN1TSHRALDH1A1

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-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF PURDUE RESEARCH FOUNDATION 2024-07-18 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-20240238458-A1 COMPOUNDS TARGETING FIBROBLAST-ACTIVATION PROTEIN AND METHODS OF USE THEREOF FAP, FIBP, FGFR1 FAAH 828/4885KMT2A 4193/4885MEN1 2971/4885

“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.