SCHEMBL23199571

SCHEMBL23199571

OB(O)c1ccc(-c2ncco2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 4/20 0.50
▸ HPGDS O60760 1/20 0.43
▸ CA2 P00918 3/20 0.42
▸ CA1 P00915 2/20 0.42
▸ MGLL Q99685 1/20 0.42
▸ HDAC4 P56524 1/20 0.41
▸ CHRNA7 P36544 1/20 0.40
▸ CHRNA10 Q9GZZ6 1/20 0.40
▸ CHRNA9 Q9UGM1 1/20 0.40
▸ ENPP2 Q13822 3/20 0.37
▸ KCNJ1 P48048 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ LPL P06858 1/20 0.35
▸ LIPG Q9Y5X9 1/20 0.35
▸ ADRB3 P13945 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
SCHEMBL722557 0.83 LTA4H (0.64) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL28320605 0.81 LTA4H (0.62) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL28257875 0.81 LTA4H (0.62) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL28362996 0.81 LTA4H (0.62) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL12730052 0.79 MGLL (0.50) LTA4HHPGDSCA2CA1MGLL
SCHEMBL2025419 0.78 LTA4H (0.55) LTA4HHPGDSHDAC4CHRNA7CHRNA10
Hydrochloric Acid SCHEMBL9218418 0.76 LTA4H (0.53) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL27529368 0.76 LTA4H (0.53) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL17704300 0.75 LTA4H (0.56) LTA4HHPGDSHDAC4CHRNA7CHRNA10
SCHEMBL19949791 0.75 HPGDS (0.39) LTA4HHPGDSHDAC4BRD4ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11046699-B2 Pyrazolo-pyrimidin-amino-cycloalkyl compounds and their therapeutic uses RAPT THERAPEUTICS, INC. (US) 2021-06-29 — — US disclosed
EP-3802544-A1 PYRAZOLO-PYRIMIDIN-AMINO-CYCLOALKYL COMPOUNDS AND THEIR THERAPEUTIC USES RAPT Therapeutics, Inc. (US) 2021-04-14 — — EP 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-11046699-B2 Pyrazolo-pyrimidin-amino-cycloalkyl compounds and their therapeutic uses GLS, GLS2, TK2 LTA4H 1251/4885HPGDS 75/4885CA2 4097/4885

“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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