SCHEMBL31378005

SCHEMBL31378005

CP(C)OC1CNc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 1/20 0.33
▸ CHRNB4 P30926 1/20 0.31
▸ CHRNA3 P32297 1/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ EPHX2 P34913 1/20 0.30

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
SCHEMBL27837408 0.79 CHRNB4 (0.35) PAX8CHRNB4CHRNA3MEN1KMT2A
SCHEMBL19158834 0.74 POLB (0.47) PAX8MEN1KMT2AKCNH2EPHX2
SCHEMBL22864426 0.72 CHRNB4 (0.33) PAX8CHRNB4CHRNA3MEN1KMT2A
SCHEMBL11049443 0.71 KCNH2 (0.33) PAX8CHRNB4CHRNA3KCNH2EPHX2
SCHEMBL3042387 0.70 MTNR1A (0.40) PAX8KCNH2EPHX2
SCHEMBL27723361 0.70 PAX8 (0.36) PAX8KCNH2
SCHEMBL9036022 0.69 EPHX2 (0.40) PAX8KCNH2EPHX2
SCHEMBL27739880 0.69 LMNA (0.39) PAX8KCNH2EPHX2
SCHEMBL5749290 0.69 HTR2C (0.46) PAX8CHRNB4CHRNA3MEN1KMT2A
SCHEMBL13372443 0.69 HTR2C (0.46) PAX8CHRNB4CHRNA3MEN1KMT2A

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
CN-114555585-B HPK1 inhibitors and uses thereof 锐格药业公司 2025-02-11 — — CN disclosed
Send feedback