SCHEMBL21081686

SCHEMBL21081686

CNC(CCCCN)C(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 4/20 0.47
▸ MMP3 P08254 4/20 0.47
▸ MMP9 P14780 4/20 0.47
▸ TLR2 O60603 1/20 0.44
▸ MMP2 P08253 2/20 0.43
▸ CPB2 Q96IY4 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CPA1 P15085 1/20 0.42
▸ CPA2 P48052 1/20 0.42
▸ CPA4 Q9UI42 1/20 0.42
▸ PRSS1 P07477 1/20 0.41
▸ PRSS2 P07478 1/20 0.41
▸ PRSS3 P35030 1/20 0.41
▸ NPY1R P25929 2/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL23052583 1.00 MMP1 (0.47) MMP1MMP3MMP9TLR2MMP2
SCHEMBL21736756 0.87 CPB2 (0.46) MMP1MMP3MMP9TLR2MMP2
SCHEMBL21081675 0.86 HTR2A (0.47) MMP3MMP2CPB2LMNATSHR
SCHEMBL21081698 0.86 HTR2A (0.47) MMP3MMP2CPB2LMNATSHR
SCHEMBL30426371 0.84 MMP2 (0.53) MMP1MMP3MMP9MMP2CPB2
SCHEMBL21742959 0.82 TSHR (0.39) MMP3MMP2LMNATSHRNPY1R
SCHEMBL13598088 0.81 MMP2 (0.56) MMP2CPB2LMNA
SCHEMBL11518823 0.81 MMP2 (0.56) MMP2CPB2LMNA
SCHEMBL24701921 0.80 NPC1 (0.52) MMP1MMP3TLR2MMP2LMNA
SCHEMBL23618430 0.80 NPC1 (0.52) MMP1MMP3TLR2MMP2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220273807-A1 CONJUGATES FOR USE IN METHODS OF TREATING CANCER ASTRAZENECA AB (SE) 2022-09-01 — — US disclosed
US-20210060172-A1 THERAPEUTIC DENDRIMERS ASTRAZENECA AB (SE) 2021-03-04 — — US disclosed
WO-2020035816-A1 CONJUGATES FOR USE IN METHODS OF TREATING CANCER ASTRAZENECA AB (SE) 2020-02-20 — — WO disclosed
WO-2020035815-A1 DENDRIMER FORMULATIONS ASTRAZENECA AB (SE) 2020-02-20 — — WO disclosed
US-10314920-B2 Therapeutic dendrimers ASTRAZENECA AB (SE) 2019-06-11 — — 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 (3 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-10314920-B2 Therapeutic dendrimers CD44, ITGAV, FOLR1 MMP1 3230/4885MMP3 2083/4885MMP9 1504/4885
US-20220273807-A1 CONJUGATES FOR USE IN METHODS OF TREATING CANCER CD44, FOLH1, SLC17A5 MMP1 1535/4885MMP3 924/4885MMP9 1519/4885
US-20210060172-A1 THERAPEUTIC DENDRIMERS CD44, ITGAV, FOLR1 MMP1 3230/4885MMP3 2083/4885MMP9 1504/4885

“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