SCHEMBL11265429

SCHEMBL11265429

CC(=O)Oc1cccc(N(C)C)c1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.60
BCHE P06276 2/20 0.60
CYP3A4 P08684 1/20 0.59
LMNA P02545 1/20 0.59
FAAH O00519 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.47
TSHR P16473 1/20 0.47
APP P05067 1/20 0.44
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B1 P14061 1/20 0.43
HSD17B2 P37059 1/20 0.43

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
SCHEMBL8375848 0.89 BCHE (0.65) ACHEBCHECYP3A4LMNAFAAH
SCHEMBL29722653 0.84 ACHE (0.61) ACHEBCHELMNAMEN1KMT2A
SCHEMBL2529775 0.84 BCHE (0.59) ACHEBCHECYP3A4LMNAFAAH
SCHEMBL28920273 0.84 MEN1 (0.66) ACHEBCHECYP3A4LMNAFAAH
SCHEMBL2331290 0.84 ACHE (0.61) ACHEBCHELMNAMEN1KMT2A
SCHEMBL9481027 0.83 MTNR1A (0.56) ACHEBCHECYP3A4LMNAMEN1
SCHEMBL9407428 0.83 BCHE (0.55) ACHEBCHECYP3A4LMNAFAAH
SCHEMBL4410973 0.82 LMNA (0.56) ACHEBCHECYP3A4LMNAMEN1
SCHEMBL17028900 0.82 LMNA (0.76) ACHECYP3A4LMNAMEN1KMT2A
SCHEMBL249305 0.82 LMNA (0.76) ACHECYP3A4LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210363124-A1 HETEROCYCLYL POLYMETHINE IR CHROMOPHORES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-11-25 US disclosed
WO-2020118116-A1 HETEROCYCLYL POLYMETHINE IR CHROMOPHORES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-06-11 WO disclosed
US-20200140404-A1 HETEROCYCLYL POLYMETHINE IR CHROMOPHORES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-05-07 US disclosed
US-4351768-A CARBONLESS, DUPLICATION, INDOLE DYES STERLING DRUG INC. (US) 1982-09-28 US disclosed
US-4322352-A Indolyl phthalide compounds STERLING DRUG INC. (US) 1982-03-30 US disclosed
US-4307018-A CHROMOGENS FOR COPYING SYSTEMS STERLING DRUG INC. (US) 1981-12-22 US disclosed
US-4251446-A COLOR PRECURSORS STERLING DRUG INC. (US) 1981-02-17 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-20200140404-A1 HETEROCYCLYL POLYMETHINE IR CHROMOPHORES SMARCE1, SMARCD1, WDR82 ACHE 4068/4885BCHE 3045/4885CYP3A4 2339/4885
US-20210363124-A1 HETEROCYCLYL POLYMETHINE IR CHROMOPHORES SMARCE1, CRY2, WDR82 ACHE 4466/4885BCHE 3465/4885CYP3A4 2362/4885

“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.