SCHEMBL31204251

SCHEMBL31204251

ON=C(Cl)c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.50
▸ GRIN2B Q13224 3/20 0.49
▸ HTT P42858 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 2/20 0.45
▸ TSHR P16473 1/20 0.43
▸ ERCC5 P28715 1/20 0.42
▸ FEN1 P39748 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ CTSL P07711 1/20 0.41
▸ CTBP2 P56545 1/20 0.41
▸ GRM5 P41594 1/20 0.40
▸ KCNK3 O14649 1/20 0.40
▸ KCNK9 Q9NPC2 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL1545140 1.00 PARP1 (0.50) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL1544382 1.00 PARP1 (0.50) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL1544383 1.00 PARP1 (0.50) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL11881373 0.78 PARP1 (0.55) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL11881377 0.78 PARP1 (0.55) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL3144887 0.77 HTT (0.62) PARP1GRIN2BHTTKDM4EGAA
SCHEMBL1777765 0.77 CES2 (0.52) PARP1GRIN2BHTTKMT2ASMN1; SMN2
SCHEMBL8250615 0.77 CES2 (0.52) PARP1GRIN2BHTTKMT2ASMN1; SMN2
SCHEMBL2929654 0.77 PARP1 (0.48) PARP1KDM4EKMT2ASMN1; SMN2MEN1
SCHEMBL2929655 0.77 PARP1 (0.48) PARP1KDM4EKMT2ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240376089-A1 3-HYDROXY-5-(ISOXAZOL-5-YL) PYRIDINE FORMYLGLYCINE COMPOUNDS, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE CHINA PHARMACEUTICAL UNIVERSITY (CN) 2024-11-14 — — 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 (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-20240376089-A1 3-HYDROXY-5-(ISOXAZOL-5-YL) PYRIDINE FORMYLGLYCINE COMPOUNDS, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE HIF1AN, HIF1A, EGLN3 PARP1 2393/4885GRIN2B 2669/4885HTT 281/4885

“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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