SCHEMBL19701701

SCHEMBL19701701

CC(NC(=O)OCc1ccccc1)C1CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.51
ITGA2B P08514 4/20 0.51
CTSK P43235 5/20 0.50
ATM Q13315 1/20 0.50
ITGAV P06756 1/20 0.50
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 6/20 0.48
TSHR P16473 5/20 0.48
PREP P48147 2/20 0.47
CYP2C9 P11712 3/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP2C19 P33261 2/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL22233840 1.00 ITGB3 (0.51) ITGB3ITGA2BCTSKATMITGAV
SCHEMBL22233607 1.00 ITGB3 (0.51) ITGB3ITGA2BCTSKATMITGAV
SCHEMBL22698689 0.91 ATM (0.56) CTSKATMCYP1A2CYP3A4TSHR
SCHEMBL21248689 0.87 ATM (0.52) CTSKATMCYP1A2CYP3A4TSHR
SCHEMBL28413840 0.85 ALDH1A1 (0.50) ITGB3ITGA2BCTSKATMITGAV
SCHEMBL31709183 0.85 ALDH1A1 (0.50) ITGB3ITGA2BCTSKATMITGAV
SCHEMBL28413841 0.85 ALDH1A1 (0.50) ITGB3ITGA2BCTSKATMITGAV
SCHEMBL7328376 0.85 ALDH1A1 (0.62) CTSKATMCYP1A2CYP3A4TSHR
SCHEMBL21062759 0.85 ITGB3 (0.53) ITGB3ITGA2BCTSKITGAVCYP1A2
SCHEMBL12310828 0.85 CTSK (0.54) CTSKATMCYP1A2CYP3A4TSHR

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-12503452-B2 Antimicrobial compounds and methods CURZA GLOBAL, LLC (US) 2025-12-23 US disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
US-20230101819-A1 SMYD Inhibitors EPIZYME INC (US) 2023-03-30 US disclosed
EP-3911644-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed
US-20170355695-A1 SMYD Inhibitors Epizyme, Inc. (US) 2017-12-14 US disclosed
US-20170355695-A1 SMYD Inhibitors Epizyme, Inc. (US) 2017-12-14 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 (4 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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 ITGB3 4036/4885ITGA2B 4619/4885CTSK 151/4885
US-20170355695-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 ITGB3 4724/4885ITGA2B 4751/4885CTSK 4477/4885
US-20230101819-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 ITGB3 4728/4885ITGA2B 4754/4885CTSK 4482/4885
US-12503452-B2 Antimicrobial compounds and methods MPO, NISCH, RPN2 ITGB3 4036/4885ITGA2B 4619/4885CTSK 151/4885

“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.