SCHEMBL20767261

SCHEMBL20767261

COC(=O)N(CCOCCOCCC(=O)O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ADRB2 P07550 1/20 0.35
ADRB1 P08588 1/20 0.35
CYP2D6 P10635 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CD274 Q9NZQ7 2/20 0.34
SLC22A2 O15244 1/20 0.34
SLC22A3 O75751 1/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
LTA4H P09960 1/20 0.33
GPR3 P46089 1/20 0.33

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
SCHEMBL17211371 1.00 ALDH1A1 (0.39) ALDH1A1LMNAKMT2AMEN1SMN1; SMN2
SCHEMBL17435149 1.00 ALDH1A1 (0.39) ALDH1A1LMNAKMT2AMEN1SMN1; SMN2
SCHEMBL2173884 1.00 ALDH1A1 (0.39) ALDH1A1LMNAKMT2AMEN1SMN1; SMN2
SCHEMBL4557245 0.90 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL4557017 0.90 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL1593611 0.90 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL259017 0.90 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL4557180 0.90 ALDH1A1 (0.39) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL4557535 0.89 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2
SCHEMBL4556420 0.89 ALDH1A1 (0.41) ALDH1A1KMT2AMEN1SMN1; SMN2ADRB2

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
EP-3672615-B1 FBSA-BASED THERAPEUTIC AND RADIOIMAGING CONJUGATES TARGETING CARBONIC ANHYDRASE POSITIVE CANCERS PURDUE RESEARCH FOUNDATION (US) 2025-04-02 EP disclosed
US-11524082-B2 FBSA-based therapeutic and radioimaging conjugates targeting carbonic anhydrase positive cancers PURDUE RESEARCH FOUNDATION (US) 2022-12-13 US disclosed
US-20200353108-A1 FBSA-BASED THERAPEUTIC AND RADIOIMAGING CONJUGATES TARGETING CARBONIC ANHYDRASE POSITIVE CANCERS PURDUE RESEARCH FOUNDATION 2020-11-12 US disclosed
EP-3672615-A1 FBSA-BASED THERAPEUTIC AND RADIOIMAGING CONJUGATES TARGETING CARBONIC ANHYDRASE POSITIVE CANCERS Purdue Research Foundation (US) 2020-07-01 EP disclosed
WO-2019040474-A1 FBSA-BASED THERAPEUTIC AND RADIOIMAGING CONJUGATES TARGETING CARBONIC ANHYDRASE POSITIVE CANCERS PURDUE RESEARCH FOUNDATION (US) 2019-02-28 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-20200353108-A1 FBSA-BASED THERAPEUTIC AND RADIOIMAGING CONJUGATES TARGETING CARBONIC ANHYDRASE POSITIVE CANCERS CA9, CA13, CA14 ALDH1A1 1153/4885LMNA 3459/4885KMT2A 559/4885
US-11524082-B2 FBSA-based therapeutic and radioimaging conjugates targeting carbonic anhydrase positive cancers CA9, CA13, CA14 ALDH1A1 1153/4885LMNA 3459/4885KMT2A 559/4885

“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.