SCHEMBL22236262

SCHEMBL22236262

COc1nc2c(c3ccccc13)CC(C(C)(C)C)CC2=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ CYP1A2 P05177 3/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ MAPT P10636 4/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ NPC1 O15118 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAT2A P31153 1/20 0.33
▸ BTK Q06187 1/20 0.32
▸ TNKS O95271 1/20 0.32
▸ TNKS2 Q9H2K2 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
SCHEMBL22236064 0.81 TP53 (0.39) TP53HPGDHSD17B10ALDH1A1MAPT
SCHEMBL22236100 0.77 MAPT (0.34) ALDH1A1CYP1A2CYP2C19MAPTNPSR1
SCHEMBL22236101 0.77 MAPT (0.34) ALDH1A1CYP1A2CYP2C19MAPTNPSR1
SCHEMBL22259795 0.75 MAPT (0.57) TP53HPGDHSD17B10ALDH1A1CYP1A2
SCHEMBL22235325 0.68 MEN1 (0.30) MEN1KMT2A
SCHEMBL22235400 0.68 KDM4E (0.31) HPGDHSD17B10ALDH1A1CYP1A2CYP2C19
SCHEMBL24357725 0.67 DRD2 (0.35) ALDH1A1MAPTNPSR1MAPK1SMN1; SMN2
SCHEMBL22235484 0.67 ALDH1A1 (0.34) HPGDHSD17B10ALDH1A1MAPTMEN1
SCHEMBL22259734 0.66 SMN1; SMN2 (0.41) TP53HPGDHSD17B10ALDH1A1CYP1A2
SCHEMBL22259781 0.66 MEN1 (0.36) TP53HPGDHSD17B10CYP1A2MAPT

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 TP53 205/4885HPGD 774/4885HSD17B10 228/4885

“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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