SCHEMBL24343672

SCHEMBL24343672

Oc1ccc2sc3cc(Cl)ccc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCKDK O14874 1/20 0.45
▸ MCL1 Q07820 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.42
▸ MIF P14174 1/20 0.40
▸ ESR1 P03372 4/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ GAA P10253 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GFER P55789 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ PSMB8 P28062 1/20 0.37

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
SCHEMBL24343656 0.93 KDM4E (0.46) BCKDKMCL1RXFP1KDM4EMIF
SCHEMBL4922476 0.90 BCKDK (0.49) BCKDKMCL1RXFP1KDM4EMIF
SCHEMBL24343663 0.90 KDM4E (0.50) KDM4EMIFESR1ALDH1A1MAPT
SCHEMBL16527316 0.86 KDM4E (0.61) BCKDKMCL1RXFP1KDM4EMIF
SCHEMBL22375225 0.82 BCKDK (0.50) BCKDKMCL1RXFP1KDM4EALDH1A1
SCHEMBL31228783 0.82 BCKDK (0.53) BCKDKMCL1RXFP1KDM4EALDH1A1
SCHEMBL8208672 0.82 HTT (0.43) KDM4EESR1ALDH1A1MAPTGAA
SCHEMBL4922527 0.82 BCKDK (0.53) BCKDKMCL1RXFP1KDM4EALDH1A1
SCHEMBL16527407 0.80 KDM4E (0.67) KDM4EMIFALDH1A1MAPTMEN1
SCHEMBL24343670 0.78 EPM2A (0.42) ALDH1A1MAPTGAAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230286882-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND AND DEUTERATED REACTION COMPOSITION LG CHEM, LTD. (KR) 2023-09-14 — — US disclosed
US-20230286882-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND AND DEUTERATED REACTION COMPOSITION LG CHEM, LTD. (KR) 2023-09-14 — — US disclosed
EP-4177238-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND AND DEUTERATED COMPOSITION Lg Chem, Ltd. (KR) 2023-05-10 — — EP disclosed
US-20230018666-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND, AND DEUTERATED REACTIVE COMPOSITION LG CHEM, LTD. (KR) 2023-01-19 — — US disclosed
WO-2022045825-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND AND DEUTERATED COMPOSITION 주식회사 엘지화학 2022-03-03 — — 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-20230018666-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND, AND DEUTERATED REACTIVE COMPOSITION AHR, TYR, ARNT BCKDK 3009/4885MCL1 2478/4885RXFP1 3498/4885
US-20230286882-A1 METHOD FOR PREPARING DEUTERATED AROMATIC COMPOUND AND DEUTERATED REACTION COMPOSITION AHR, PAH, HDHD5 BCKDK 855/4885MCL1 3547/4885RXFP1 3710/4885

“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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