SCHEMBL20622928

SCHEMBL20622928

CC(C)CC(O)CNC(C)C

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.41
ADRB1 P08588 3/20 0.41
ADRB3 P13945 3/20 0.41
CYP2D6 P10635 1/20 0.41
KISS1R Q969F8 2/20 0.41
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
MAPT P10636 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
SCHEMBL26324877 0.84 ADRB2 (0.41) ADRB2ADRB1ADRB3CYP2D6PTGS1
SCHEMBL15509647 0.83 ADRB2 (0.47) ADRB2ADRB1ADRB3CYP2D6PTGS1
SCHEMBL12912652 0.80 KISS1R (0.71) ADRB2ADRB1ADRB3CYP2D6KISS1R
SCHEMBL12891638 0.78 KISS1R (0.50) ADRB2ADRB1ADRB3KISS1R
SCHEMBL12891643 0.78 KISS1R (0.50) ADRB2ADRB1ADRB3KISS1R
SCHEMBL16173875 0.77 ADRB2 (0.40) ADRB2ADRB1ADRB3CYP2D6PTGS1
SCHEMBL4373913 0.76
SCHEMBL4139553 0.76
SCHEMBL4374793 0.76
SCHEMBL18647360 0.76

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11229709-B2 Dendrimer drug conjugates for sustained intra-articular delivery MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2022-01-25 US disclosed
US-20210017400-A1 Molecularly Well-defined Antibiofouling and Polyionic Coatings ACatechol, Inc. (US) 2021-01-21 US disclosed
US-20200155692-A1 DENDRIMER DRUG CONJUGATES FOR SUSTAINED INTRA-ARTICULAR DELIVERY UNITED STATES GOVERNMENT 2020-05-21 US disclosed
WO-2019005966-A1 DENDRIMER DRUG CONJUGATES FOR SUSTAINED INTRA-ARTICULAR DELIVERY MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2019-01-03 WO 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-20200155692-A1 DENDRIMER DRUG CONJUGATES FOR SUSTAINED INTRA-ARTICULAR DELIVERY CD44, ITGA6, ITGA2B ADRB2 2104/4885ADRB1 2090/4885ADRB3 2375/4885
US-11229709-B2 Dendrimer drug conjugates for sustained intra-articular delivery CD44, ITGA6, ITGA2B ADRB2 2104/4885ADRB1 2090/4885ADRB3 2375/4885

“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.