SCHEMBL19358016

SCHEMBL19358016

Cc1cc(C(N)=O)cc(Br)c1C

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.49
▸ TSHR P16473 2/20 0.49
▸ APOBEC3A P31941 1/20 0.49
▸ APOBEC3G Q9HC16 1/20 0.49
▸ NCOA1 Q15788 1/20 0.42
▸ NCOA3 Q9Y6Q9 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ PARP1 P09874 2/20 0.39
▸ POLB P06746 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ MAP2K1 Q02750 1/20 0.35

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
SCHEMBL29710362 1.00 HTT (0.49) HTTTSHRAPOBEC3AAPOBEC3GNCOA1
SCHEMBL1003817 0.89 TSHR (0.53) HTTTSHRAPOBEC3AAPOBEC3GNCOA1
SCHEMBL18471225 0.84 SMN1; SMN2 (0.49) HTTTSHRAPOBEC3AAPOBEC3GSMN1; SMN2
SCHEMBL12659328 0.81 NPC1 (0.45) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29710249 0.81 TTR (0.56) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5631374 0.81 TTR (0.56) TSHRSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL1505378 0.80 TSHR (0.44) HTTTSHRAPOBEC3AAPOBEC3GNCOA1
SCHEMBL29710347 0.76 CA12 (0.48) TSHRALDH1A1POLBMAPTKDM4E
SCHEMBL19357846 0.76 CA12 (0.48) TSHRALDH1A1POLBMAPTKDM4E
SCHEMBL482111 0.75 CHRNA1 (0.50) HTTTSHRAPOBEC3AAPOBEC3GSMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108698992-B 2-cyanoisoindoline derivatives for the treatment of cancer 特殊治疗有限公司 2022-04-19 — — CN disclosed
EP-3429994-B1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER MISSION THERAPEUTICS LTD (GB) 2021-06-16 — — EP disclosed
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer MISSION THERAPEUTICS LIMITED (GB) 2020-06-16 — — US disclosed
EP-3429994-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER Mission Therapeutics Limited (GB) 2019-01-23 — — EP disclosed
US-20190010122-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER MISSION THERAPEUTICS LIMITED (GB) 2019-01-10 — — US disclosed
WO-2017158388-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER MISSION THERAPEUTICS LIMITED (GB) 2017-09-21 — — 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-20190010122-A1 2-CYANOISOINDOLINE DERIVATIVES FOR TREATING CANCER USP7, USP47, USP2 HTT 3323/4885TSHR 4510/4885APOBEC3A 961/4885
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer USP7, USP47, USP2 HTT 3323/4885TSHR 4510/4885APOBEC3A 961/4885

“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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