SCHEMBL29639160

SCHEMBL29639160

O=c1[nH]c(-c2ccccc2)cc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TNKS O95271 6/20 0.63
▸ PARP1 P09874 2/20 0.60
▸ KDM4E B2RXH2 6/20 0.57
▸ HPGD P15428 4/20 0.57
▸ ALDH1A1 P00352 3/20 0.57
▸ NPC1 O15118 2/20 0.57
▸ RAB9A P51151 2/20 0.57
▸ LMNA P02545 2/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57
▸ GAA P10253 1/20 0.56
▸ HSD17B10 Q99714 2/20 0.53
▸ LOXL2 Q9Y4K0 1/20 0.53
▸ CTSV O60911 1/20 0.53
▸ TUBB4A P04350 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ TUBB P07437 1/20 0.53
▸ CTSL P07711 1/20 0.53
▸ TUBA3C P0DPH7 1/20 0.53
▸ TUBA1B P68363 1/20 0.53
▸ TUBA4A P68366 1/20 0.53

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
SCHEMBL828493 1.00 TNKS (0.63) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL30161077 0.86 TNKS (0.65) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL4774571 0.86 TNKS (0.61) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL28629565 0.86 TNKS (0.61) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL311943 0.86 TNKS (0.61) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL30160913 0.86 PARP1 (0.61) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL28924699 0.86 TNKS (0.65) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL28624953 0.86 PARP1 (0.61) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL22201443 0.86 ALDH1A1 (0.59) TNKSPARP1KDM4EHPGDALDH1A1
SCHEMBL16578791 0.86 TNKS (0.61) TNKSPARP1KDM4EHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113666925-B Method for synthesizing isoindolo [2,1-b ] isoquinoline-5 (7H) -ketone compound 广州大学 2022-05-17 — — CN claimed
EP-4709711-A1 ISOQUINOLINONE DERIVATIVES AND 4H-QUINOLIZINONE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASE Beone Medicines I GmbH (CH) 2026-03-18 — — EP disclosed
WO-2024230803-A1 ISOQUINOLINONE DERIVATIVES AND 4H-QUINOLIZINONE DERIVATIVES AND PHARMARCEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASE BEIGENE, LTD. (GB) 2024-11-14 — — WO disclosed
CN-115521310-A Synthesis method of isoindole isoquinoline spironaphthone compound 河南师范大学 2022-12-27 — — CN disclosed
CN-113666925-B Method for synthesizing isoindolo [2,1-b ] isoquinoline-5 (7H) -ketone compound 广州大学 2022-05-17 — — CN disclosed
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