SCHEMBL26603616

SCHEMBL26603616

[CH2]c1ccc(NC(=O)[C@H](CCCCN)NC(=O)COCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCn2cc(CNC(=O)CCCC#Cc3cnc(C[SH](=O)=O)nc3)nn2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 5/20 0.34
▸ DGAT1 O75907 3/20 0.31
▸ NMT2 O60551 1/20 0.31
▸ NMT1 P30419 1/20 0.31
▸ HDAC3 O15379 1/20 0.30
▸ HDAC4 P56524 1/20 0.30
▸ HDAC1 Q13547 1/20 0.30
▸ HDAC7 Q8WUI4 1/20 0.30
▸ HDAC2 Q92769 1/20 0.30
▸ HDAC10 Q969S8 1/20 0.30
▸ HDAC11 Q96DB2 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30
▸ HDAC9 Q9UKV0 1/20 0.30
▸ HDAC5 Q9UQL6 1/20 0.30
▸ NCOR2 Q9Y618 1/20 0.30
▸ F2R P25116 1/20 0.30
▸ SIRT2 Q8IXJ6 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
SCHEMBL27189806 0.91 FOLH1 (0.34) FOLH1DGAT1NMT2NMT1HDAC3
SCHEMBL22561476 0.83 FOLH1 (0.34) FOLH1DGAT1NMT2NMT1F2R
SCHEMBL22618763 0.82 FOLH1 (0.34) FOLH1DGAT1NMT2NMT1
SCHEMBL27189819 0.77 NMT2 (0.33) FOLH1NMT2NMT1HDAC3HDAC4
SCHEMBL25204552 0.74 TTR (0.46) FOLH1DGAT1F2R
SCHEMBL27189815 0.73 DGAT1 (0.35) FOLH1DGAT1HDAC3HDAC4HDAC1
SCHEMBL23690568 0.71 FOLH1 (0.40) FOLH1DGAT1
SCHEMBL22238237 0.70 FOLH1 (0.41) FOLH1DGAT1F2R
SCHEMBL23193195 0.70 OPRM1 (0.34) FOLH1SIRT2
SCHEMBL22618791 0.70 FOLH1 (0.34) FOLH1DGAT1

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-20230338565-A1 ANTIBODY DRUG CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-10-26 — — 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-20230338565-A1 ANTIBODY DRUG CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF EPCAM, DSC1, CNTN1 FOLH1 171/4885DGAT1 3637/4885NMT2 1153/4885

“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.

Send feedback