SCHEMBL23365111

SCHEMBL23365111

Brc1ccnc(C2CCOC2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 2/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ PIM1 P11309 2/20 0.35
▸ MAP3K12 Q12852 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ ACVR2A P27037 1/20 0.32
▸ TGFBR2 P37173 1/20 0.32
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ CHEK1 O14757 1/20 0.31
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ HDAC3 O15379 1/20 0.31
▸ HDAC4 P56524 1/20 0.31
▸ HDAC7 Q8WUI4 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ HDAC9 Q9UKV0 1/20 0.31

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
SCHEMBL29979625 1.00 PIK3CD (0.36) PIK3CDPIK3CAPIM1MAP3K12KDM4E
SCHEMBL25147436 0.90 MAPK8 (0.38) PIM1MAP3K12KDM4EALDH1A1SMN1; SMN2
SCHEMBL29979598 0.90 PIK3CD (0.43) PIK3CDPIK3CAMAP3K12KDM4EALDH1A1
SCHEMBL16692772 0.90 PIK3CD (0.43) PIK3CDPIK3CAMAP3K12KDM4EALDH1A1
SCHEMBL29850110 0.86 KDM4E (0.36) KDM4EALDH1A1SMN1; SMN2HDAC3HDAC4
SCHEMBL29979707 0.80 PIK3CD (0.36) PIK3CDPIK3CAPIM1MAP3K12ACVR2A
SCHEMBL23365116 0.80 PIK3CD (0.36) PIK3CDPIK3CAPIM1MAP3K12ACVR2A
SCHEMBL20676296 0.80 CCR1 (0.42) PIK3CDPIK3CAPIM1MAP3K12KDM4E
SCHEMBL930803 0.80 HDAC4 (0.42) KDM4EALDH1A1SMN1; SMN2HDAC3HDAC4
SCHEMBL30281430 0.80 HDAC4 (0.42) KDM4EALDH1A1SMN1; SMN2HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230147993-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF CAPULUS THERAPEUTICS, LLC 2023-05-11 — — US disclosed
US-20230147993-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF CAPULUS THERAPEUTICS, LLC 2023-05-11 — — US disclosed
US-20230147993-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF CAPULUS THERAPEUTICS, LLC 2023-05-11 — — US disclosed
EP-4058016-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF Capulus Therapeutics, LLC (US) 2022-09-21 — — EP disclosed
WO-2021097123-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF CAPULUS THERAPEUTICS, LLC (US) 2021-05-20 — — WO disclosed
WO-2021097123-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF CAPULUS THERAPEUTICS, LLC (US) 2021-05-20 — — 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-20230147993-A1 THIOPHENE COMPOUNDS WITH CYCLIC AMIDES, AND USES THEREOF SREBF1, SREBF2, FABP1 PIK3CD 2348/4885PIK3CA 1862/4885PIM1 1038/4885

“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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