SCHEMBL25296904

SCHEMBL25296904

O=C(O)c1cnn2cc(OCBr)ccc12

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ ROCK2 O75116 10/20 0.35
▸ EPHB3 P54753 2/20 0.34
▸ PTPN1 P18031 1/20 0.34
▸ ALKBH1 Q13686 1/20 0.34
▸ PDE2A O00408 3/20 0.33
▸ EIF4A3 P38919 1/20 0.33
▸ LCK P06239 1/20 0.33
▸ CSK P41240 1/20 0.33

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
SCHEMBL25252411 0.87 ROCK2 (0.40) ROCK2
SCHEMBL25298933 0.87 EPHB3 (0.36) ROCK2EPHB3PDE2AEIF4A3LCK
SCHEMBL31546959 0.86 PLA2G4B (0.43) KDM4EALDH1A1PDE2A
SCHEMBL17437904 0.84 PRKAB2 (0.40) KDM4EALDH1A1ROCK2
SCHEMBL25253242 0.84 EPHB3 (0.40) ROCK2EPHB3PDE2ALCKCSK
SCHEMBL17437950 0.83 ROCK2 (0.47) ROCK2EPHB3ALKBH1PDE2A
SCHEMBL17437917 0.82 ALKBH1 (0.53) EPHB3ALKBH1
SCHEMBL23888941 0.82 NR1H4 (0.44) ROCK2PDE2A
SCHEMBL15882108 0.82 PRKAB2 (0.41) KDM4EALDH1A1ROCK2PDE2A
SCHEMBL19128902 0.81 LMNA (0.42) KDM4EALDH1A1ROCK2PDE2A

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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF SHENZHEN ZHONGGE BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 2023-07-13 — — 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-20230219979-A1 PYRAZOLO[1,5-a]PYRIDINE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF RET, GRK4, RIN1 KDM4E 2232/4885ALDH1A1 1772/4885ROCK2 772/4885

“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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