SCHEMBL22807658

SCHEMBL22807658

COC(=O)C(CCCCNC(=O)COCCOCCOCCNC(=O)CCCCCN1C(=O)C=CC1=O)NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.43
▸ AKT1 P31749 1/20 0.42
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ BCHE P06276 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ HDAC1 Q13547 2/20 0.36
▸ HDAC8 Q9BY41 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ SIRT2 Q8IXJ6 1/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ SIRT3 Q9NTG7 1/20 0.36
▸ ADORA1 P30542 2/20 0.36
▸ CAPN1 P07384 1/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL24202346 0.93 GLP1R (0.51) GLP1RAKT1HPGDHTTSMN1; SMN2
SCHEMBL22807637 0.90 HPGD (0.40) GLP1RAKT1HPGDHTTSMN1; SMN2
SCHEMBL15096516 0.84 POLB (0.45) AKT1HDAC1HDAC8MEN1KMT2A
SCHEMBL31721990 0.84 AKT1 (0.51) GLP1RAKT1HDAC1HDAC8SIRT2
SCHEMBL19384704 0.81 HPGD (0.47) AKT1HPGDHTTSMN1; SMN2HDAC1
SCHEMBL19384786 0.81 HPGD (0.47) AKT1HPGDHTTSMN1; SMN2HDAC1
SCHEMBL18798881 0.81 TDP1 (0.42) GLP1RMEN1KMT2APOLBNPSR1
SCHEMBL16924988 0.81 TDP1 (0.42) GLP1RMEN1KMT2APOLBNPSR1
SCHEMBL18942764 0.81 AKT1 (0.52) AKT1HPGDHTTSMN1; SMN2HDAC1
SCHEMBL25133970 0.80 PLK1 (0.46) AKT1HPGDHTTSMN1; SMN2TDP1

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-10869863-B2 Multi-arm polymeric targeting anti-cancer conjugate BRIGHTGENE BIO-MEDICAL TECHNOLOGY CO., LTD. (CN) 2020-12-22 — — 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-10869863-B2 Multi-arm polymeric targeting anti-cancer conjugate TOP2A, TOP1, ABCG2 GLP1R 3412/4885AKT1 928/4885HPGD 4151/4885

“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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