SCHEMBL22737366

SCHEMBL22737366

Nc1cc(F)cc2c1C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.67
▸ DDB1 Q16531 11/20 0.67
▸ TNF P01375 2/20 0.65
▸ IKZF3 Q9UKT9 2/20 0.65
▸ IL1B P01584 1/20 0.65
▸ TBXA2R P21731 1/20 0.65
▸ IKZF1 Q13422 1/20 0.65
▸ ALDH1A1 P00352 1/20 0.58
▸ CHRM2 P08172 1/20 0.58
▸ OPRM1 P35372 1/20 0.58
▸ CYP1A2 P05177 1/20 0.58
▸ TSHR P16473 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ HDAC1 Q13547 1/20 0.49
▸ HDAC2 Q92769 1/20 0.49

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
SCHEMBL24379097 0.88 CRBN (0.69) CRBNDDB1TNFIKZF3IL1B
SCHEMBL25650349 0.87 CRBN (0.67) CRBNDDB1TNFIKZF3IL1B
SCHEMBL25650287 0.87 CRBN (0.67) CRBNDDB1TNFIKZF3IL1B
SCHEMBL19451377 0.86 CRBN (0.66) CRBNDDB1TNFIKZF3IL1B
SCHEMBL25275500 0.85 CRBN (0.61) CRBNDDB1TNFIKZF3IL1B
SCHEMBL12041884 0.85 CRBN (0.67) CRBNDDB1TNFIKZF3IL1B
SCHEMBL24745183 0.85 CRBN (0.65) CRBNDDB1TNFIKZF3IL1B
SCHEMBL15439893 0.85 CRBN (0.67) CRBNDDB1TNFIKZF3IL1B
SCHEMBL25271938 0.84 CRBN (0.62) CRBNDDB1TNFIKZF3IL1B
SCHEMBL25223335 0.84 CRBN (0.62) CRBNDDB1TNFIKZF3IL1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117586340-A Bifunctional compound for targeted degradation of METTL3, pharmaceutical composition and application 中国科学院上海药物研究所 2024-02-23 — — CN disclosed
WO-2024035626-A1 HALOPHTHALIMIDE COMPOUNDS AND METHODS OF USE AGAINST TBI, INFLAMMATORY DISORDER, AUTOIMMUNE DISORDER, NEURODEGENERATIVE DISEASE OR VIRAL INFECTION THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-02-15 — — WO disclosed
EP-4180432-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2023-05-17 — — EP disclosed
WO-2022111526-A1 BENZENE RING DERIVATIVE, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 四川海思科制药有限公司 2022-06-02 — — WO disclosed
WO-2022007903-A1 COMPOUND CAPABLE OF INHIBITING AND DEGRADING ANDROGEN RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS AND PHARMACEUTICAL USES THEREOF 四川海思科制药有限公司 2022-01-13 — — WO disclosed
WO-2022007824-A1 COMPOUND HAVING BTK KINASE DEGRADING ACTIVITY, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREFOR 四川海思科制药有限公司 2022-01-13 — — WO disclosed
WO-2020239103-A1 BTK INHIBITOR RING DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 2020-12-03 — — WO disclosed
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