SCHEMBL29700458

SCHEMBL29700458

CCN(CC)C(=O)CN1CCCN(CC(=O)N(CC)CC)CCN(CC(=O)N(CC)CC)CCCN(CC(=O)N(CC)CC)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
MDM2 Q00987 1/20 0.53
ALDH1A1 P00352 2/20 0.51
KMT2A Q03164 1/20 0.45
SIGMAR1 Q99720 5/20 0.44
LMNA P02545 2/20 0.41
HTT P42858 1/20 0.40
BCHE P06276 1/20 0.40
TSPO P30536 1/20 0.40
HTR1A P08908 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.37

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
SCHEMBL20605092 0.94 KDM4E (0.50) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL6039643 0.92 KDM4E (0.49) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL8259566 0.86 HTR1A (0.55) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL19049402 0.84 KDM4E (0.50) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL2649295 0.82 KDM4E (0.46) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL6765965 0.82 SIGMAR1 (0.61) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL12932756 0.81 KDM4E (0.48) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL11608912 0.80 SIGMAR1 (0.66) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL2649407 0.80 KDM4E (0.50) KDM4EMDM2ALDH1A1KMT2ASIGMAR1
SCHEMBL2650435 0.80 KDM4E (0.50) KDM4EMDM2ALDH1A1KMT2ASIGMAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113453720-B Dual ligand drug conjugate and uses thereof 同宜医药(苏州)有限公司 2025-05-06 CN disclosed
US-20220175761-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF COHERENT BIOPHARMA SUZHOU LTD (CN) 2022-06-09 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-20220175761-A1 BI-LIGAND DRUG CONJUGATE AND USE THEREOF SLC10A1, CD47, SELPLG KDM4E 2989/4885MDM2 2785/4885ALDH1A1 1722/4885

“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.