SCHEMBL30550837

SCHEMBL30550837

CC1(C)OC[C@@H](CCCn2ccc3cc(-c4ncc(C(F)(F)F)cn4)c(F)c(F)c3c2=O)N1C(=O)OCc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 1/20 0.33
▸ NR1H2 P55055 1/20 0.32
▸ NR1H3 Q13133 1/20 0.32
▸ GPBAR1 Q8TDU6 1/20 0.32
▸ GRM2 Q14416 3/20 0.31
▸ TSHR P16473 2/20 0.31
▸ FAAH O00519 1/20 0.31
▸ TRPC3 Q13507 1/20 0.30
▸ TRPC7 Q9HCX4 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ PTGES O14684 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
SCHEMBL26782493 1.00 CETP (0.33) CETPNR1H2NR1H3GPBAR1GRM2
SCHEMBL25320077 0.90 TIPARP (0.32) —
SCHEMBL25901613 0.84 HTR2C (0.34) FAAHTRPC3TRPC7NPSR1
SCHEMBL31058376 0.84 HTR2C (0.34) FAAHTRPC3TRPC7NPSR1
SCHEMBL30550891 0.76 HTR1A (0.33) GRM2
SCHEMBL25320710 0.76 HTR1A (0.33) GRM2
SCHEMBL26782492 0.75 TNF (0.34) TRPC3TRPC7NPSR1
SCHEMBL31058380 0.75 TNF (0.34) TRPC3TRPC7NPSR1
SCHEMBL25321271 0.73 TIPARP (0.33) —
SCHEMBL25898093 0.72 LMNA (0.41) GRM2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459922-B2 PARP7 inhibitors GILEAD SCIENCES, INC. (US) 2025-11-04 — — US disclosed
EP-4469448-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2024-12-04 — — EP disclosed
CN-118591537-A PARP7 inhibitors 吉利德科学公司 2024-09-03 — — CN disclosed
US-20230365529-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. 2023-11-16 — — US disclosed
WO-2023147418-A1 PARP7 INHIBITORS GILEAD SCIENCES, INC. (US) 2023-08-03 — — 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 (2 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-12459922-B2 PARP7 inhibitors PARP1, PARP11, PARP2 CETP 3533/4885NR1H2 2769/4885NR1H3 2249/4885
US-20230365529-A1 PARP7 INHIBITORS PARP1, PARP11, PARP2 CETP 3533/4885NR1H2 2769/4885NR1H3 2249/4885

“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.

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