SCHEMBL29626448

SCHEMBL29626448

CCCCN(C(=O)OCc1ccccc1)[C@@H]1CCc2cc(OCc3ccccc3)c(NCC(=O)OC(C)(C)C)c(F)c2C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.38
CCR5 P51681 3/20 0.37
TMEM97 Q5BJF2 2/20 0.36
HTR2A P28223 1/20 0.34
MC4R P32245 1/20 0.34
CCRL2 O00421 1/20 0.33
MAPT P10636 1/20 0.32
XBP1 P17861 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
ACHE P22303 1/20 0.32
GHSR Q92847 1/20 0.32

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
SCHEMBL25338313 0.92 TRPM8 (0.40) TRPM8CCR5TMEM97HTR2AMC4R
SCHEMBL29132495 0.86 CCR5 (0.38) TRPM8CCR5TMEM97HTR2AMC4R
SCHEMBL29132471 0.81 RORC (0.35) CCR5HTR2ACA1CA2ACHE
SCHEMBL22412225 0.81 CA1 (0.50) MAPTXBP1NPSR1TDP1CA1
SCHEMBL29626370 0.81 CA1 (0.50) MAPTXBP1NPSR1TDP1CA1
SCHEMBL22412223 0.81 CA1 (0.50) MAPTXBP1NPSR1TDP1CA1
SCHEMBL29626302 0.79 CCR5 (0.33) TRPM8CCR5TMEM97HTR2A
SCHEMBL29132492 0.79 CCR5 (0.33) TRPM8CCR5TMEM97HTR2A
SCHEMBL29626234 0.79 CA1 (0.43) CA1CA2ACHE
SCHEMBL29132503 0.79 CA1 (0.43) CA1CA2ACHE

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-20250122160-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2025-04-17 US disclosed
EP-4211122-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF Calico Life Sciences LLC (US) 2023-07-19 EP disclosed
WO-2022056281-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2022-03-17 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 (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-20250122160-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF PTPN1, PTPN2, PTPN18 TRPM8 4505/4885CCR5 3184/4885TMEM97 3008/4885

“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.