SCHEMBL22016826

SCHEMBL22016826

Cc1nnc(CC(N)=O)nn1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
F2 P00734 1/20 0.38
CA2 P00918 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL2091085 0.68 HTT (1.00) HTTALDH1A1RAB9AL3MBTL1
SCHEMBL12527639 0.68 HTT (0.53) HTTCA2ALDH1A1RAB9AL3MBTL1
SCHEMBL18214725 0.66 HTT (0.50) HTTALDH1A1RAB9AL3MBTL1
SCHEMBL11551529 0.66 HTT (0.50) HTTF2CA2ALDH1A1RAB9A
SCHEMBL2760902 0.64 HTT (0.44) HTTCA2ALDH1A1RAB9AL3MBTL1
SCHEMBL15750231 0.64 SETDB1 (0.44) ALDH1A1RAB9A
SCHEMBL11141178 0.63 CYP1A2 (0.67) HTTF2CA2RAB9A
SCHEMBL15660357 0.62 ALDH1A1 (0.37) CA2ALDH1A1
SCHEMBL7962293 0.62 HTT (0.47) HTTF2CA2
SCHEMBL28380963 0.62 HTT (0.52) HTTF2CA2

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-11129909-B2 Conjugate and block copolymer containing fluorescent chromophore and preparation method therefor and use thereof UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA (CN) 2021-09-28 US disclosed
US-20200155707-A1 CONJUGATE AND BLOCK COPOLYMER CONTAINING FLUORESCENT CHROMOPHORE AND PREPARATION METHOD THEREFOR AND USE THEREOF UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA (CN) 2020-05-21 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-11129909-B2 Conjugate and block copolymer containing fluorescent chromophore and preparation method therefor and use thereof WEE1, FAR1, FURIN HTT 3687/4885F2 385/4885CA2 3280/4885
US-20200155707-A1 CONJUGATE AND BLOCK COPOLYMER CONTAINING FLUORESCENT CHROMOPHORE AND PREPARATION METHOD THEREFOR AND USE THEREOF WEE1, FAR1, FURIN HTT 3687/4885F2 385/4885CA2 3280/4885

“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.