SCHEMBL30482017

SCHEMBL30482017

CC(C)NCc1ccccc1C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.46
▸ PPARG P37231 2/20 0.46
▸ IDO1 P14902 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ POLB P06746 1/20 0.45
▸ SCN8A Q9UQD0 1/20 0.44
▸ BCHE P06276 1/20 0.44
▸ ACHE P22303 1/20 0.44
▸ ATM Q13315 1/20 0.42
▸ TACR1 P25103 1/20 0.42
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ MRGPRX1 Q96LB2 1/20 0.42

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
SCHEMBL800327 1.00 EPHX2 (0.46) EPHX2PPARGIDO1KDM4EALDH1A1
SCHEMBL25377665 0.87 EPHX2 (0.41) EPHX2PPARGKDM4EALDH1A1POLB
SCHEMBL28170854 0.85 SCN8A (0.52) EPHX2PPARGIDO1KDM4EALDH1A1
SCHEMBL18893127 0.84 EPHX2 (0.44) EPHX2PPARGIDO1POLBSCN8A
SCHEMBL13208315 0.83 BCHE (0.45) ALDH1A1POLBBCHEACHE
SCHEMBL11621026 0.83 BCHE (0.40) EPHX2PPARGIDO1ALDH1A1POLB
SCHEMBL13865872 0.83 HDAC4 (0.49) EPHX2PPARGTACR1SLC6A2SLC6A4
SCHEMBL26030471 0.80 BCHE (0.43) ALDH1A1POLBBCHEACHEATM
SCHEMBL3272017 0.80 BCHE (0.55) KDM4EALDH1A1POLBBCHEACHE
SCHEMBL12153198 0.79 SCN8A (0.49) EPHX2PPARGIDO1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136594-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2025-05-01 — — US disclosed
EP-4469438-A1 COMPOUNDS AND METHODS OF USE Tango Therapeutics, Inc. (US) 2024-12-04 — — EP disclosed
WO-2023146987-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — 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 (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-20250136594-A1 COMPOUNDS AND METHODS OF USE CNKSR1, UGT1A1, REV1 EPHX2 543/4885PPARG 1081/4885IDO1 1948/4885

“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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