SCHEMBL22734584

SCHEMBL22734584

O=C(NN1CCOc2ccccc21)c1cnc2c(-c3cc(F)cc(F)c3F)nccc2c1N1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ USP2 O75604 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ STAT6 P42226 1/20 0.33
▸ ATR Q13535 4/20 0.33
▸ ATRIP Q8WXE1 4/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ MAPK8 P45983 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ PIK3CA P42336 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
SCHEMBL29454705 1.00 TP53 (0.34) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL22734603 0.93 ALDH1A1 (0.32) ALDH1A1
SCHEMBL29440686 0.93 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22734610 0.93 ALDH1A1 (0.33) ALDH1A1MAPK8
SCHEMBL22734525 0.90 MEN1 (0.35) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL29440678 0.90 MEN1 (0.35) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL29440691 0.90 TP53 (0.38) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL22734530 0.90 TP53 (0.38) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL22734527 0.89 MEN1 (0.36) TP53MEN1KMT2AUSP2MAPK1
SCHEMBL29440720 0.89 MEN1 (0.36) TP53MEN1KMT2AUSP2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12448391-B2 Bicyclic derivatives for treating endoparasites ELANCO TIERGESUNDHEIT AG (CH) 2025-10-21 — — US claimed
US-20240360116-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (SZ) 2024-10-31 — — US claimed
CN-116888124-A Bicyclic derivatives 礼蓝动物保健有限公司 2023-10-13 — — CN claimed
US-20220242857-A1 BICYCLIC DERIVATIVES FOR TREATING ENDOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2022-08-04 — — US claimed
CN-114206860-A Bicyclic derivatives for the treatment of endoparasites 礼蓝动物保健有限公司 2022-03-18 — — CN claimed
US-20200385398-A1 NEW BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG 2020-12-10 — — US claimed
WO-2020247747-A1 BICYCLIC DERIVATIVES FOR TREATING ENDOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2020-12-10 — — WO claimed
US-20240360116-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (SZ) 2024-10-31 — — US disclosed
CN-116888124-A Bicyclic derivatives 礼蓝动物保健有限公司 2023-10-13 — — CN disclosed
WO-2022117783-A1 BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG (CH) 2022-06-09 — — WO disclosed
US-20200385398-A1 NEW BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG 2020-12-10 — — US disclosed
US-20200385398-A1 NEW BICYCLIC DERIVATIVES ELANCO TIERGESUNDHEIT AG 2020-12-10 — — US disclosed
WO-2020247747-A1 BICYCLIC DERIVATIVES FOR TREATING ENDOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2020-12-10 — — 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 (4 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-12448391-B2 Bicyclic derivatives for treating endoparasites TBXA2R, PIGS, CYCS TP53 4879/4885MEN1 2037/4885KMT2A 2765/4885
US-20240360116-A1 BICYCLIC DERIVATIVES FABP3, CYCS, TNNI3 TP53 4884/4885MEN1 2797/4885KMT2A 2925/4885
US-20220242857-A1 BICYCLIC DERIVATIVES FOR TREATING ENDOPARASITES TBXA2R, PIGS, CYCS TP53 4879/4885MEN1 2037/4885KMT2A 2765/4885
US-20200385398-A1 NEW BICYCLIC DERIVATIVES CYCS, FABP3, TNNI3 TP53 4885/4885MEN1 3381/4885KMT2A 3657/4885

“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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