SCHEMBL23716946

SCHEMBL23716946

CCc1cc(OCCCCO)c2ccccc2n1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NCF1 P14598 4/20 0.51
▸ AGTR1 P30556 1/20 0.47
▸ AGTR2 P50052 1/20 0.47
▸ PARP1 P09874 1/20 0.44
▸ PDE4A P27815 5/20 0.44
▸ PDE4B Q07343 5/20 0.44
▸ PDE3B Q13370 5/20 0.44
▸ PDE3A Q14432 5/20 0.44
▸ PDE10A Q9Y233 5/20 0.44
▸ P2RY12 Q9H244 1/20 0.41

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
SCHEMBL30388939 1.00 NCF1 (0.51) NCF1AGTR1AGTR2PARP1PDE4A
SCHEMBL88762 0.84 NCF1 (0.52) NCF1AGTR1AGTR2
SCHEMBL30388617 0.83 NCF1 (0.51) NCF1AGTR1AGTR2PDE4APDE4B
SCHEMBL5538132 0.79 KDM4E (0.51) NCF1AGTR1AGTR2
SCHEMBL10677788 0.79 ACP1 (0.62) NCF1
SCHEMBL29531776 0.79 NCF1 (0.44) NCF1AGTR1AGTR2
SCHEMBL89580 0.78 NCF1 (0.49) NCF1PDE4APDE4BPDE3BPDE3A
SCHEMBL31425610 0.78 NCF1 (0.49) NCF1PARP1PDE4APDE4BPDE3B
SCHEMBL8290938 0.77 LMNA (0.58) AGTR1AGTR2PDE4APDE4BPDE3B
SCHEMBL13168773 0.77 PDE4A (0.42) NCF1AGTR1AGTR2PARP1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459921-B2 Isoindoline compound, preparation method, pharmaceutical composition and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2025-11-04 — — US disclosed
CN-114085212-B Isoindoline compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2023-05-02 — — CN disclosed
CN-114085212-A Isoindoline compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2022-02-25 — — CN disclosed
US-20220041576-A1 ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2022-02-10 — — US disclosed
CN-110963994-B Isoindoline compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2022-02-08 — — CN disclosed
EP-3862348-A1 ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2021-08-11 — — EP disclosed
CN-110963994-A Isoindoline compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2020-04-07 — — CN 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 (2 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-12459921-B2 Isoindoline compound, preparation method, pharmaceutical composition and use thereof CUL4B, CUL4A, UBQLN1 NCF1 2631/4885AGTR1 2173/4885AGTR2 2503/4885
US-20220041576-A1 ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF CUL4B, CUL4A, UBQLN1 NCF1 2631/4885AGTR1 2173/4885AGTR2 2503/4885

“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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