SCHEMBL21160708

SCHEMBL21160708

CN(C)c1ccc2cc(/C=C(\C#N)C(=O)O)sc2c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.45
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SLC16A3 O15427 1/20 0.40
SLC16A1 P53985 1/20 0.40
SNCA P37840 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
SCHEMBL22313935 0.86 APP (0.41) APPMAPTSLC16A3SLC16A1
SCHEMBL21234685 0.84 APP (0.43) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL22784074 0.80 KDM4E (0.40) ALDH1A1SLC16A3SLC16A1
SCHEMBL22314051 0.78 DNM1 (0.43) MAPTMEN1KMT2AALDH1A1
SCHEMBL22314181 0.78 APP (0.72) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL22295850 0.76 MAPT (0.39) MAPTALDH1A1SLC16A3SLC16A1
SCHEMBL22784086 0.76 KDM4E (0.40) MAPTMEN1KMT2AALDH1A1SLC16A3
SCHEMBL21234738 0.74 ATM (0.35) MAPTALDH1A1SLC16A3SLC16A1
SCHEMBL22295772 0.73 SLC16A3 (0.46) APPMAPTMEN1KMT2AALDH1A1
SCHEMBL15859154 0.73 MAPT (0.72) APPMAPTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11209437-B2 Fluorescent probe and preparation method and use thereof FLUORESCENCE DIAGNOSIS (SHANGHAI) BIOTECH COMPANY (CN) 2021-12-28 US disclosed
US-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2020-08-06 US disclosed
US-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2019-06-20 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-20190187144-A1 FLUORESCENT PROBE AND PREPARATION METHOD AND USE THEREOF HNRNPF, HNRNPUL2, RAB5IF APP 2001/4885MAPT 2624/4885MEN1 2099/4885
US-20200248069-A1 FLUORESCENT PROBE, PREPARATION METHOD THEREFOR AND USE THEREOF WASF2, FAM162A, HASPIN APP 2264/4885MAPT 3407/4885MEN1 1100/4885
US-11209437-B2 Fluorescent probe and preparation method and use thereof HNRNPF, HNRNPUL2, RAB5IF APP 2001/4885MAPT 2624/4885MEN1 2099/4885

“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.