SCHEMBL20530282

SCHEMBL20530282

CCCCC(NC(=O)NC(CC(=O)O)c1ccc2c(c1)OCO2)C(=O)N(Cc1cccs1)Cc1cccs1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
HPGD P15428 1/20 0.46
TRPM8 Q7Z2W7 1/20 0.43
GAA P10253 1/20 0.42
TAS1R3 Q7RTX0 3/20 0.40
TAS1R1 Q7RTX1 3/20 0.40
ITGB3 P05106 7/20 0.39
ITGA2B P08514 6/20 0.39
ITGAV P06756 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL17009347 1.00 POLB (0.46) POLBHPGDTRPM8GAATAS1R3
SCHEMBL6127212 1.00 POLB (0.46) POLBHPGDTRPM8GAATAS1R3
SCHEMBL6127110 1.00 POLB (0.46) POLBHPGDTRPM8GAATAS1R3
SCHEMBL4698443 1.00 POLB (0.46) POLBHPGDTRPM8GAATAS1R3
SCHEMBL6122200 1.00 POLB (0.46) POLBHPGDTRPM8GAATAS1R3
SCHEMBL4700500 0.96 POLB (0.43) POLBHPGDTRPM8GAATAS1R3
SCHEMBL7900077 0.96 HPGD (0.44) POLBHPGDTRPM8GAATAS1R3
SCHEMBL24119265 0.95 POLB (0.47) POLBHPGDTRPM8GAATAS1R3
SCHEMBL7901816 0.93 POLB (0.45) POLBHPGDTRPM8GAATAS1R3
SCHEMBL4698454 0.93 POLB (0.42) POLBHPGDTRPM8GAATAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107820429-B Novel compositions and methods for immunotherapy comprising small molecule integrin receptor-ligand agonist adjuvants 7山药物有限责任公司 2022-08-16 CN disclosed
US-20210393811-A1 Imaging Agents and Methods of Use TEXAS HEART INSTITUTE 2021-12-23 US disclosed
WO-2020072784-A1 IMAGING AGENTS AND METHODS OF USE TEXAS HEART INSTITUTE (US) 2020-04-09 WO disclosed
EP-3388429-A1 AGONISTS THAT ENHANCE BINDING OF INTEGRIN-EXPRESSING CELLS TO INTEGRIN RECEPTORS Texas Heart Institute (US) 2018-10-17 EP 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 (1 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-20210393811-A1 Imaging Agents and Methods of Use ITGA1, ITGA4, CD47 POLB 4644/4885HPGD 4754/4885TRPM8 1025/4885

“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.