SCHEMBL18232117

SCHEMBL18232117

CCCOCCOCCOCCn1nnc2c1-c1ccccc1N(C(=O)CCC(=O)NCCOCCOCCOCCOCCC(=O)NC(C(C)=O)C(C)C)Cc1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CMKLR1 Q99788 2/20 0.45
▸ HSPA5 P11021 1/20 0.36
▸ HSPA9 P38646 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ FOLH1 Q04609 1/20 0.33
▸ NAMPT P43490 1/20 0.30
▸ MTNR1A P48039 1/20 0.30
▸ MTNR1B P49286 1/20 0.30
▸ TP53 P04637 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
SCHEMBL16803939 0.91 CMKLR1 (0.47) CMKLR1LMNANAMPTMTNR1AMTNR1B
SCHEMBL18866868 0.85 CMKLR1 (0.43) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL26751803 0.84 CMKLR1 (0.41) CMKLR1LMNANAMPTMTNR1AMTNR1B
SCHEMBL26346652 0.83 CMKLR1 (0.43) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL18855045 0.82 CMKLR1 (0.43) CMKLR1HSPA5HSPA9LMNANAMPT
SCHEMBL25559432 0.81 CMKLR1 (0.45) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL25812374 0.81 CMKLR1 (0.44) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL18866884 0.80 CMKLR1 (0.39) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL26731076 0.80 CMKLR1 (0.39) CMKLR1HSPA5HSPA9LMNAFOLH1
SCHEMBL25559424 0.80 CMKLR1 (0.42) CMKLR1HSPA5HSPA9LMNAFOLH1

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-20160331842-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES ARARIS BIOTECH LTD (CH) 2016-11-17 — — 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-20160331842-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES DNPEP, ENPEP, PEPD CMKLR1 3613/4885HSPA5 3401/4885HSPA9 3520/4885

“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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