SCHEMBL17724229

SCHEMBL17724229

O=C1CC[C@H](N2Cc3c(NCc4cc(OCCO)ccc4F)cccc3C2=O)C(=O)N1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 14/20 0.54
▸ IKZF3 Q9UKT9 3/20 0.54
▸ DDB1 Q16531 2/20 0.54
▸ IKZF1 Q13422 2/20 0.52
▸ CSNK1A1 P48729 1/20 0.52
▸ STAT3 P40763 1/20 0.49
▸ TNF P01375 3/20 0.48
▸ BRD4 O60885 2/20 0.48
▸ IL1B P01584 1/20 0.48
▸ HDAC3 O15379 1/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ MAP1LC3B Q9GZQ8 2/20 0.47

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
SCHEMBL17724238 1.00 CRBN (0.54) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724108 1.00 CRBN (0.54) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724219 0.91 CRBN (0.54) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724221 0.91 CRBN (0.54) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724220 0.91 CRBN (0.54) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724086 0.90 TNF (0.61) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL19532843 0.90 CRBN (0.52) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724204 0.90 CRBN (0.52) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724223 0.90 TNF (0.61) CRBNIKZF3DDB1IKZF1CSNK1A1
SCHEMBL17724142 0.90 CRBN (0.52) CRBNIKZF3DDB1IKZF1CSNK1A1

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
EP-3643709-B1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF KANGPU BIOPHARMACEUTICALS LTD (CN) 2021-10-20 — — EP disclosed
EP-3643709-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Kangpu Biopharmaceuticals, Ltd. (CN) 2020-04-29 — — EP disclosed
US-10017492-B2 Isoindoline derivative, intermediate, preparation method, pharmaceutical composition and use thereof KANGPU BIOPHARMACEUTICALS, LTD. (CN) 2018-07-10 — — US disclosed
US-10017492-B2 Isoindoline derivative, intermediate, preparation method, pharmaceutical composition and use thereof KANGPU BIOPHARMACEUTICALS, LTD. (CN) 2018-07-10 — — US disclosed
US-20170313676-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF KANGPU BIOPHARMACEUTICALS, LTD. (CN) 2017-11-02 — — US disclosed
US-20170313676-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF KANGPU BIOPHARMACEUTICALS, LTD. (CN) 2017-11-02 — — US disclosed
EP-3214081-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Kangpu Biopharmaceuticals, Ltd. (CN) 2017-09-06 — — EP disclosed
WO-2016065980-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF 康朴生物医药技术(上海)有限公司 2016-05-06 — — 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 (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-10017492-B2 Isoindoline derivative, intermediate, preparation method, pharmaceutical composition and use thereof IL2, IL1B, IL5 CRBN 3765/4885IKZF3 208/4885DDB1 3019/4885
US-20170313676-A1 ISOINDOLINE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF IL2, IL1B, IL5 CRBN 3765/4885IKZF3 208/4885DDB1 3019/4885

“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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