SCHEMBL29584487

SCHEMBL29584487

O=C(O)C1CCNC2(CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.46
▸ GABRP O00591 2/20 0.46
▸ GABRD O14764 2/20 0.46
▸ GABRA1 P14867 2/20 0.46
▸ GABRB1 P18505 2/20 0.46
▸ GABRG2 P18507 2/20 0.46
▸ GABRB3 P28472 2/20 0.46
▸ GABRA5 P31644 2/20 0.46
▸ GABRA3 P34903 2/20 0.46
▸ GABRA2 P47869 2/20 0.46
▸ GABRB2 P47870 2/20 0.46
▸ GABRA4 P48169 2/20 0.46
▸ GABRE P78334 2/20 0.46
▸ GABRA6 Q16445 2/20 0.46
▸ GABRG1 Q8N1C3 2/20 0.46
▸ GABRG3 Q99928 2/20 0.46
▸ GABRQ Q9UN88 2/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ GRM2 Q14416 2/20 0.42
▸ GRM3 Q14832 2/20 0.42

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
SCHEMBL29585583 0.92 TSHR (0.43) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL15618894 0.88 TSHR (0.47) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL19815193 0.84 TSHR (0.42) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL9715688 0.82 TSHR (0.43) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL19814952 0.82 TSHR (0.41) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL1665499 0.82 TSHR (0.43) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL10970110 0.82 TSHR (0.43) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL29583225 0.82 KMT2A (0.38) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL19971630 0.80 CYP2C19 (0.50) TSHRGABRPGABRDGABRA1GABRB1
SCHEMBL29243441 0.77 CHRNB2 (0.38) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12606541-B2 PPARg modulators and methods of use EISAI R&D MANAGEMENT CO., LTD. (JP) 2026-04-21 — — US disclosed
EP-4522605-A1 SOLID FORM OF PPAR-GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2025-03-19 — — EP disclosed
WO-2023219879-A1 SOLID FORM OF PPAR-gamma MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-11-16 — — WO disclosed
EP-4240736-A1 PPAR GAMMA MODULATORS AND METHODS OF USE Eisai R&D Management Co., Ltd. (JP) 2023-09-13 — — EP disclosed
US-20230128198-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL AS AURORA A SELECTIVE INHIBITORS JACOBIO PHARMACEUTICALS CO., LTD (CN) 2023-04-27 — — US disclosed
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE EISAI R&D MANAGEMENT CO., LTD. (JP) 2023-03-02 — — US disclosed
US-11384066-B1 Heterocyclic compounds useful as aurora a selective inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-07-12 — — US disclosed
WO-2022099144-A1 ΡΡΑRγ MODULATORS AND METHODS OF USE Eisai R&D Mangement Co., Ltd. (JP) 2022-05-12 — — 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-11384066-B1 Heterocyclic compounds useful as aurora a selective inhibitors AURKA, AURKC, AURKB TSHR 4268/4885GABRP 4342/4885GABRD 4835/4885
US-20230128198-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL AS AURORA A SELECTIVE INHIBITORS AURKA, AURKC, AURKB TSHR 4215/4885GABRP 4354/4885GABRD 4852/4885
US-20230062861-A1 PPARg MODULATORS AND METHODS OF USE PPARG, PPARA, PPARD TSHR 391/4885GABRP 340/4885GABRD 333/4885
US-12606541-B2 PPARg modulators and methods of use PPARG, PPARA, PPARD TSHR 142/4885GABRP 492/4885GABRD 373/4885

“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.

Send feedback