SCHEMBL24076885

SCHEMBL24076885

CC(C)c1n[nH]c(=O)c2ccc(C(C)(C)O)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.43
▸ TSHR P16473 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ PRMT5 O14744 3/20 0.35
▸ WDR77 Q9BQA1 3/20 0.35
▸ PARP1 P09874 7/20 0.34
▸ TNKS O95271 6/20 0.34
▸ TNKS2 Q9H2K2 6/20 0.34
▸ PARP2 Q9UGN5 1/20 0.34
▸ PARP3 Q9Y6F1 1/20 0.34
▸ CHEK1 O14757 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PRKAB2 O43741 1/20 0.33
▸ PRKAG1 P54619 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
SCHEMBL24076279 0.88 POLB (0.42) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL29426569 0.84 MAPT (0.44) POLBTSHRSMN1; SMN2PRMT5WDR77
SCHEMBL24076896 0.84 MAPT (0.44) POLBTSHRSMN1; SMN2PRMT5WDR77
SCHEMBL24076281 0.82 POLB (0.40) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL29426515 0.78 PARP1 (0.42) POLBTSHRSMN1; SMN2PRMT5WDR77
SCHEMBL26732910 0.78 PARP1 (0.42) POLBTSHRSMN1; SMN2PRMT5WDR77
SCHEMBL22552265 0.76 POLB (0.44) POLBTSHRSMN1; SMN2CYP1A2PRMT5
SCHEMBL24076266 0.76 POLB (0.44) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL30452337 0.76 POLB (0.44) POLBTSHRSMN1; SMN2NPC1RAB9A
SCHEMBL24076884 0.75 MEN1 (0.47) SMN1; SMN2PRMT5WDR77PARP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
US-20230202989-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-29 — — US disclosed
WO-2021239885-A1 COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2021-12-02 — — 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-20230202989-A1 COMPOUNDS NLRP3, NLRP1, IL1B POLB 3231/4885TSHR 4236/4885SMN1; SMN2 4739/4885

“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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