SCHEMBL29132508

SCHEMBL29132508

CCOC(=O)CC1CCc2cc(OCc3ccccc3)c(Br)c(F)c2C1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.38
FFAR1 O14842 1/20 0.37
FABP4 P15090 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
NR1H4 Q96RI1 1/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL30683967 1.00 PTGIR (0.38) PTGIRFFAR1FABP4HTR2AHTR2C
SCHEMBL25338586 0.88 ITGB3 (0.43) PTGIRFFAR1HTR2AHTR2CITGB3
SCHEMBL25338513 0.84 BRD4 (0.37) HTR2AHTR2CCA1CA2ACHE
SCHEMBL25336821 0.82 PTGIR (0.37) PTGIRFABP4HTR2AHTR2CCA1
SCHEMBL25339339 0.80 MEN1 (0.35) CA1CA2ACHELMNA
SCHEMBL29132484 0.80 CYP11B1 (0.34) KDM4E
SCHEMBL29626339 0.80 CYP11B1 (0.34) KDM4E
SCHEMBL22412174 0.80 CA1 (0.44) CA1CA2ACHE
SCHEMBL29626301 0.79 ACACB (0.41)
SCHEMBL29132497 0.79 S1PR5 (0.38) PTGIRFFAR1HTR2CITGB3ITGA2B

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
US-20250122160-A1 PROTEIN TYROSINE PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF CALICO LIFE SCIENCES LLC (US) 2025-04-17 US disclosed
CN-116829555-A Protein tyrosine phosphatase inhibitors and methods of use thereof 卡里科生命科学有限责任公司 2023-09-29 CN 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 PTGIR 3209/4885FFAR1 1760/4885FABP4 989/4885

“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.