SCHEMBL31105017

SCHEMBL31105017

O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1cnc(N2CCC(N3CCNCC3)CC2)c(-c2cc[nH]n2)c1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 20/20 0.64
▸ KCNH2 Q12809 2/20 0.57
▸ BCR P11274 1/20 0.57
▸ CRBN Q96SW2 1/20 0.57

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
SCHEMBL22682102 0.87 ABL1 (0.65) ABL1
Asciminib SCHEMBL15388502 0.87 ABL1 (0.76) ABL1KCNH2BCRCRBN
Asciminib SCHEMBL15388505 0.87 ABL1 (0.76) ABL1KCNH2BCRCRBN
Asciminib SCHEMBL29521537 0.86 ABL1 (0.75) ABL1KCNH2BCRCRBN
SCHEMBL26183964 0.86 ABL1 (0.86) ABL1KCNH2BCRCRBN
SCHEMBL31101084 0.81 ABL1 (0.56) ABL1
SCHEMBL31101051 0.81 ABL1 (0.56) ABL1KCNH2BCRCRBN
SCHEMBL26354087 0.81 ABL1 (0.63) ABL1
SCHEMBL26353934 0.81 ABL1 (0.67) ABL1KCNH2BCRCRBN
SCHEMBL31099648 0.81 ABL1 (0.57) ABL1KCNH2BCRCRBN

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
CN-120202200-A Oxo-isoindolinyl substituted tetrahydropyrimidinedione-based compounds and applications thereof 标新生物医药科技(上海)有限公司 2025-06-24 — — CN disclosed
WO-2024245443-A1 COMPOUND BASED ON OXOISOINDOLINYL SUBSTITUTED TETRAHYDRO-2-PYRIMIDONE, AND USE THEREOF 标新生物医药科技(上海)有限公司 2024-12-05 — — WO disclosed
WO-2024188209-A1 NEW E3 UBIQUITIN LIGASE LIGAND, PROTEIN DEGRADATION AGENT AND USE THEREOF 标新生物医药科技(上海)有限公司 2024-09-19 — — WO disclosed
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