SCHEMBL24357387

SCHEMBL24357387

COc1cccc2c1nc1n2CC(C(C)(C)C)CC1NCc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ VCP P55072 6/20 0.38
▸ DRD2 P14416 1/20 0.37
▸ SLC2A1 P11166 1/20 0.35
▸ BCHE P06276 3/20 0.34
▸ ACHE P22303 3/20 0.34
▸ BACE1 P56817 3/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ TLR8 Q9NR97 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ KDM1A O60341 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ GRM2 Q14416 1/20 0.33

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
SCHEMBL24357386 0.84 CXCR4 (0.39) VCPBCHETLR8
SCHEMBL22236144 0.68 CASR (0.36) TLR8ALDH1A1GRM2
SCHEMBL24357725 0.63 DRD2 (0.35) DRD2MEN1KMT2AALDH1A1LMNA
SCHEMBL5201559 0.60 MAPK1 (0.43) DRD2TLR8GRM2
SCHEMBL29829591 0.60 CASR (0.60) MEN1KMT2ATLR8ALDH1A1GAA
SCHEMBL29829696 0.58 TLR8 (0.51) MEN1KMT2ATLR8LMNAL3MBTL1
SCHEMBL29829518 0.58 CASR (0.60) TLR8ALDH1A1LMNAGAAPOLB
SCHEMBL5204121 0.57 TP53 (0.44) KMT2ATLR8ALDH1A1
SCHEMBL25069692 0.57 FUCA1 (0.57) KDM1AMAOAMAOB
SCHEMBL25069530 0.57 FUCA1 (0.57) KDM1AMAOAMAOB

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 1 patent. 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

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 VCP 3323/4885DRD2 802/4885SLC2A1 1388/4885

“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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