SCHEMBL25183266

SCHEMBL25183266

O=c1[nH]ncc2cc(Sc3ccccc3)ccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.57
▸ PARP1 P09874 1/20 0.57
▸ PRKCI P41743 1/20 0.57
▸ PDE4B Q07343 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ MAOA P21397 2/20 0.44
▸ MAOB P27338 2/20 0.44
▸ PRMT5 O14744 1/20 0.43
▸ WDR77 Q9BQA1 1/20 0.43
▸ KDR P35968 1/20 0.42
▸ EGLN2 Q96KS0 3/20 0.39
▸ EGLN1 Q9GZT9 3/20 0.39
▸ MCL1 Q07820 2/20 0.39
▸ BCL2 P10415 1/20 0.39
▸ PIM1 P11309 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ KDM5B Q9UGL1 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36

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
SCHEMBL30375279 1.00 ALDH1A1 (0.57) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25198709 0.84 HSD17B10 (0.49) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375027 0.82 HAO1 (0.44) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25180455 0.82 HAO1 (0.44) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25173842 0.79 ALDH1A1 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375726 0.79 ALDH1A1 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25183258 0.79 ALDH1A1 (0.46) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375154 0.77 ALDH1A1 (0.42) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25202577 0.77 ALDH1A1 (0.42) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25184055 0.77 ALDH1A1 (0.44) ALDH1A1PARP1PRKCIPDE4BHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426681-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS Sitryx Therapeutics Limited (GB) 2024-09-11 — — EP disclosed
CN-118317951-A Phthalazine derivatives as pyruvate kinase modulators 西特瑞治疗有限公司 2024-07-09 — — CN disclosed
WO-2023079294-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS SITRYX THERAPEUTICS LIMITED (GB) 2023-05-11 — — WO disclosed
WO-2023079294-A1 PHTHALAZINE DERIVATIVES AS PYRUVATE KINASE MODULATORS SITRYX THERAPEUTICS LIMITED (GB) 2023-05-11 — — WO disclosed
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