SCHEMBL24649114

SCHEMBL24649114

CCc1ccc(F)c2sc(N)nc12

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CXCR2 P25025 6/20 0.36
▸ HTT P42858 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ MPL P40238 2/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ CXCR1 P25024 1/20 0.32

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
SCHEMBL24785018 0.87 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1LMNACXCR2HTT
SCHEMBL30339919 0.77 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL289153 0.77 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL23985953 0.77 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL25919103 0.75 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1LMNACXCR2HTT
SCHEMBL26064294 0.74 HPGD (0.44) SMN1; SMN2ALDH1A1HTTMAPTNPC1
SCHEMBL27051764 0.74 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1LMNACXCR2HTT
SCHEMBL24632436 0.74 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNAHTTMAPT
SCHEMBL289152 0.74 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNACXCR2HTT
SCHEMBL21091402 0.74 PDPK1 (0.49) SMN1; SMN2ALDH1A1LMNAHTTMPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 — — US disclosed
US-20240226113-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2024-07-11 — — US disclosed
WO-2024138206-A1 FLUOROPYRIDOPYRIMIDINE AND FLUOROQUINAZOLINE DERIVATIES AND METHODS OF USE THEREOF FRONTIER MEDICINES CORPORATION (US) 2024-06-27 — — WO disclosed
US-20240025918-A1 KRAS G12D Inhibitors JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2024-01-25 — — US disclosed
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-11-09 — — US disclosed
WO-2023215801-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-11-09 — — WO disclosed
US-20230242552-A1 Nitrogen-Containing Heterocyclic Compound, Preparation Method Therefor and Use Thereof 280 Bio, Inc (US) 2023-08-03 — — US disclosed
US-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF InventisBio Co., Ltd. (CN) 2023-08-03 — — US disclosed
WO-2023141300-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-07-27 — — WO disclosed
WO-2023103906-A1 KRAS G12D INHIBITOR AND USE IN MEDICINE 贝达药业股份有限公司 2023-06-15 — — WO disclosed
US-20220281893-A1 TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2022-09-08 — — US 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 (7 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-20220281893-A1 TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF OXA1L, CACNA1I, GRIK5 SMN1; SMN2 1164/4885ALDH1A1 1402/4885LMNA 3975/4885
US-20240226113-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TP53, HRAS, KRAS SMN1; SMN2 1518/4885ALDH1A1 2917/4885LMNA 2568/4885
US-20230242544-A1 QUINAZOLINE COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS SMN1; SMN2 4219/4885ALDH1A1 1817/4885LMNA 3720/4885
US-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS SMN1; SMN2 1713/4885ALDH1A1 2871/4885LMNA 4027/4885
US-20230242552-A1 Nitrogen-Containing Heterocyclic Compound, Preparation Method Therefor and Use Thereof NRAS, KRAS, RAB8A SMN1; SMN2 3043/4885ALDH1A1 2748/4885LMNA 3082/4885
US-20230357233-A1 HETEROARYL COMPOUNDS, PREPARATION METHODS AND USES THEREOF KRAS, NRAS, HRAS SMN1; SMN2 4580/4885ALDH1A1 1158/4885LMNA 3767/4885
US-20240025918-A1 KRAS G12D Inhibitors KRAS, NRAS, HRAS SMN1; SMN2 3857/4885ALDH1A1 3208/4885LMNA 2462/4885

“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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