SCHEMBL24070594

SCHEMBL24070594

COC(=O)c1c(N)nc(Cl)c(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.41
▸ GAA P10253 4/20 0.41
▸ HPGD P15428 3/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.39
▸ NQO2 P16083 5/20 0.37
▸ KDM4E B2RXH2 4/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CASP1 P29466 2/20 0.36
▸ CASP7 P55210 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ MAPK10 P53779 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ MAPT P10636 2/20 0.35
▸ ATM Q13315 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ MDM2 Q00987 1/20 0.35
▸ PKM P14618 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
SCHEMBL5568741 0.82 NPSR1 (0.43) ALDH1A1GAAHPGDNPSR1KDM4E
SCHEMBL27192988 0.78 ALDH1A1 (0.41) ALDH1A1GAAHPGDNPSR1NQO2
SCHEMBL9396189 0.76 NPSR1 (0.44) ALDH1A1GAAHPGDNPSR1NQO2
SCHEMBL24070597 0.76 TDP1 (0.48) ALDH1A1GAAHPGDKDM4EKMT2A
Dacthal SCHEMBL53477 0.75 CA12 (0.48) ALDH1A1GAAHPGDNPSR1KDM4E
Dacthal SCHEMBL8827292 0.75 CA12 (0.48) ALDH1A1GAAHPGDNPSR1KDM4E
SCHEMBL29987712 0.75 NPSR1 (0.54) ALDH1A1GAAHPGDNPSR1NQO2
SCHEMBL507599 0.75 NPSR1 (0.54) ALDH1A1GAAHPGDNPSR1NQO2
SCHEMBL11023076 0.74 NPSR1 (0.48) ALDH1A1GAAHPGDNPSR1NQO2
SCHEMBL10321291 0.73 NPSR1 (0.47) ALDH1A1GAAHPGDNPSR1NQO2

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
WO-2024041573-A1 FUSED MULTI-HETEROCYCLIC COMPOUNDS AS KRAS G12D MODULATORS AND USES THEREOF ZAI LAB (SHANGHAI) CO., LTD. (CN) 2024-02-29 — — WO disclosed
CN-115551867-B Fused tricyclic compounds, pharmaceutical compositions and uses thereof 劲方医药科技(上海)有限公司 2024-02-20 — — CN disclosed
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — US disclosed
US-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2023-06-29 — — US disclosed
CN-115551867-A Fused tricyclic compound, pharmaceutical composition and application thereof 劲方医药科技(上海)有限公司 2022-12-30 — — CN disclosed
WO-2021239058-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF 劲方医药科技(上海)有限公司 2021-12-02 — — 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 (1 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-20230203060-A1 FUSED TRICYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION THEREOF, AND USE THEREOF KRAS, NRAS, TP53 ALDH1A1 3223/4885GAA 810/4885HPGD 2426/4885

“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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