SCHEMBL30375726

SCHEMBL30375726

O=c1[nH]ncc2cc(Sc3ccc(OC(F)F)cc3)ccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ PARP1 P09874 1/20 0.41
▸ PRKCI P41743 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.40
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PRMT5 O14744 1/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ DAO P14920 2/20 0.34
▸ SYK P43405 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CCR6 P51684 1/20 0.33

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
SCHEMBL25173842 1.00 ALDH1A1 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25180455 0.83 HAO1 (0.44) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375027 0.83 HAO1 (0.44) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25183266 0.79 ALDH1A1 (0.57) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375279 0.79 ALDH1A1 (0.57) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL24076270 0.72 ALDH1A1 (0.47) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL29655133 0.72 ALDH1A1 (0.47) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL30375367 0.72 ALDH1A1 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL25200648 0.72 ALDH1A1 (0.41) ALDH1A1PARP1PRKCIPDE4BHSD17B10
SCHEMBL1009542 0.70 HSD17B10 (0.51) 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 3 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
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