SCHEMBL25877172

SCHEMBL25877172

NC(=O)COCCOCNC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)CCCCCN1C(=O)C=CC1=O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.43
CCKAR P32238 8/20 0.41
CCKBR P32239 8/20 0.41
CD40 P25942 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL20041046 0.97 AKT1 (0.45) AKT1CCKARCCKBRALDH1A1SMN1; SMN2
SCHEMBL20345224 0.97 AKT1 (0.45) AKT1CCKARCCKBRALDH1A1SMN1; SMN2
SCHEMBL26170798 0.92 OPRD1 (0.43) AKT1
SCHEMBL25871152 0.91 AKT1 (0.45) AKT1CCKARCCKBRALDH1A1SMN1; SMN2
SCHEMBL25877099 0.91 AKT1 (0.43) AKT1CD40ALDH1A1SMN1; SMN2
SCHEMBL28385639 0.90 AKT1 (0.46) AKT1ALDH1A1SMN1; SMN2
SCHEMBL22768342 0.90 AKT1 (0.46) AKT1ALDH1A1SMN1; SMN2
SCHEMBL28385636 0.90 AKT1 (0.46) AKT1ALDH1A1SMN1; SMN2
SCHEMBL18224261 0.90 AKT1 (0.46) AKT1ALDH1A1SMN1; SMN2
SCHEMBL17003582 0.90 AKT1 (0.46) AKT1ALDH1A1SMN1; SMN2

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
US-20230331738-A1 ANTI-TUMOR COMPOUND AND PREPARATION METHOD AND USE THEREOF DUALITY BIOLOGICS (SUZHOU) CO., LTD. (CN) 2023-10-19 US disclosed
US-20230212182-A1 ANTI-TUMOR COMPOUND AND PREPARATION METHOD AND USE THEREOF DUALITY BIOLOGICS (SUZHOU) CO., LTD. (CN) 2023-07-06 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 (2 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-20230212182-A1 ANTI-TUMOR COMPOUND AND PREPARATION METHOD AND USE THEREOF RCC2, REN, VHL AKT1 2403/4885CCKAR 876/4885CCKBR 1459/4885
US-20230331738-A1 ANTI-TUMOR COMPOUND AND PREPARATION METHOD AND USE THEREOF RCC2, REN, VHL AKT1 2403/4885CCKAR 876/4885CCKBR 1459/4885

“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.