SCHEMBL26962575

SCHEMBL26962575

CC(C)(C)[S+]([O-])N[C@H]1CCOc2c(F)cccc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.40
TRPV1 Q8NER1 8/20 0.33
TERT O14746 1/20 0.32
P2RX7 Q99572 1/20 0.32
ADRA2B P18089 1/20 0.30
ADRA1A P35348 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
JAK3 P52333 1/20 0.30

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
SCHEMBL27120222 1.00 ADRA2A (0.40) ADRA2ATRPV1TERTP2RX7ADRA2B
SCHEMBL31316674 0.81 OPRL1 (0.36) TRPV1
SCHEMBL19973540 0.81 TRPV1 (0.36) TRPV1
SCHEMBL19973547 0.81 TRPV1 (0.36) TRPV1
SCHEMBL19973539 0.81 TRPV1 (0.36) TRPV1
SCHEMBL26962684 0.80 SSTR4 (0.39) TRPV1
SCHEMBL30280539 0.80 ADRA2A (0.40) ADRA2ATRPV1P2RX7
SCHEMBL27121725 0.80 ADRA2A (0.40) ADRA2ATRPV1P2RX7
SCHEMBL26962559 0.80 ADRA2A (0.40) ADRA2ATRPV1P2RX7
SCHEMBL26962756 0.80 MAP3K14 (0.38)

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-20240150339-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2024-05-09 US disclosed
EP-4291557-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2023-12-20 EP disclosed
CN-116848107-A Compounds and their use as PDE4 activators 米罗尼德有限公司 2023-10-03 CN disclosed
WO-2022172037-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2022-08-18 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-20240150339-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE4B, PDE4C ADRA2A 100/4885TRPV1 2110/4885TERT 2604/4885

“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.