SCHEMBL22235658

SCHEMBL22235658

COC(=O)c1c(O)c2c(n(C)c1=O)-c1cc(OC(F)F)c3ncccc3c1CC2C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 3/20 0.35
▸ KAT2B Q92831 2/20 0.33
▸ KDM4E B2RXH2 5/20 0.32
▸ NPC1 O15118 3/20 0.31
▸ RAB9A P51151 3/20 0.31
▸ MAPT P10636 3/20 0.31
▸ USP2 O75604 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ TP53 P04637 2/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NLRP3 Q96P20 1/20 0.31
▸ HTT P42858 1/20 0.30
▸ LIPG Q9Y5X9 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
SCHEMBL22235664 0.87 PDE4D (0.32) PDE4DKAT2BKDM4EALDH1A1
SCHEMBL24357109 0.84 PDE4D (0.34) PDE4DKDM4E
SCHEMBL22235347 0.82 PDE4D (0.30) PDE4D
SCHEMBL22235351 0.82 PDE4D (0.30) PDE4D
SCHEMBL29728910 0.82 PDE4D (0.30) PDE4D
SCHEMBL22235348 0.82 PDE4D (0.30) PDE4D
SCHEMBL22235214 0.80 KDM4E (0.32) PDE4DKAT2BKDM4ENPC1RAB9A
SCHEMBL29728938 0.80 KDM4E (0.32) PDE4DKAT2BKDM4ENPC1RAB9A
SCHEMBL22235212 0.80 KDM4E (0.32) PDE4DKAT2BKDM4ENPC1RAB9A
SCHEMBL22236114 0.79 — —

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-20220125771-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-04-28 — — US disclosed
CN-113825756-A Substituted polycyclic carboxylic acids, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2021-12-21 — — CN disclosed
EP-3911653-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2021-11-24 — — EP disclosed
WO-2020150366-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2020-07-23 — — 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-20220125771-A1 SUBSTITUTED POLYCYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME SLC10A1, NR1H4, HDGF PDE4D 3456/4885KAT2B 2069/4885KDM4E 1195/4885

“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.

Send feedback