SCHEMBL31626679

SCHEMBL31626679

CC(CCC(=O)NCC(=O)NCC(=O)NCC(=O)NCCC(=O)O)N1C(=O)C=CC1=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.37
▸ ECE1 P42892 3/20 0.35
▸ FAAH O00519 2/20 0.34
▸ CNR1 P21554 2/20 0.34
▸ CNR2 P34972 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ NAMPT P43490 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ITGB3 P05106 2/20 0.33
▸ ITGA2B P08514 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ FPR2 P25090 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CCKBR P32239 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 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
SCHEMBL31447851 0.81 LMNA (0.32) ALDH1A1LMNANAMPTHPGDHSD17B10
SCHEMBL30529639 0.80 SMN1; SMN2 (0.45) ALDH1A1LMNAPKMTSHRHPGD
Trifluoroacetic Acid SCHEMBL27959221 0.76 ALDH1A1 (0.35) ALDH1A1LMNAPKMITGB3ITGA2B
SCHEMBL11927649 0.74 PTGS1 (0.54) ALDH1A1FAAHCNR1CNR2LMNA
SCHEMBL326701 0.74 PTGS1 (0.47) ALDH1A1LMNAHPGDHSD17B10
SCHEMBL28536934 0.72 PTGS1 (0.50) ALDH1A1LMNATSHR
SCHEMBL16399076 0.69 ALDH1A1 (0.55) ALDH1A1ECE1FAAHCNR1CNR2
SCHEMBL19147460 0.69 PTGS1 (0.54) ALDH1A1ECE1FAAHLMNAPKM
SCHEMBL18384184 0.69 ALDH1A1 (0.31) ALDH1A1LMNAHPGDNPSR1
SCHEMBL16006863 0.69 PTGS1 (0.54) ALDH1A1FAAHLMNAPKMTSHR

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-20250195679-A1 ANTIBODY-DRUG CONJUGATE AND USE THEREOF SHANGHAI HUAOTA BIOPHARMACEUTICAL CO., LTD. (CN) 2025-06-19 — — 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-20250195679-A1 ANTIBODY-DRUG CONJUGATE AND USE THEREOF ENTPD3, ENTPD1, NT5E ALDH1A1 1826/4885ECE1 1670/4885FAAH 2479/4885

“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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