SCHEMBL11652353

SCHEMBL11652353

c1ccc2c(c1)sc1ncnn12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.53
▸ CHEK1 O14757 1/20 0.44
▸ PDGFRA P16234 1/20 0.44
▸ CDK5 Q00535 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ LRRK2 Q5S007 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ DYRK1B Q9Y463 1/20 0.44
▸ TNKS2 Q9H2K2 1/20 0.44
▸ PARP2 Q9UGN5 1/20 0.44
▸ L3MBTL1 Q9Y468 4/20 0.40
▸ LMNA P02545 3/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ PKM P14618 1/20 0.38
▸ HPGD P15428 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38

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
SCHEMBL11652215 0.75 PARP15 (0.40) ALDH1A1CHEK1PDGFRADYRK1ALRRK2
SCHEMBL11656137 0.75 PARP2 (0.50) CHEK1PDGFRADYRK1ALRRK2CLK4
SCHEMBL11650673 0.75 PARP10 (0.50) ALDH1A1TNKS2PARP2L3MBTL1RAB9A
SCHEMBL11651190 0.72 EGLN2 (0.40) TNKS2PARP2L3MBTL1LMNARAB9A
SCHEMBL11653345 0.72 EGLN2 (0.40) L3MBTL1LMNARAB9APKMHPGD
SCHEMBL11656317 0.69 ALDH1A1 (1.00) ALDH1A1CHEK1PDGFRACDK5DYRK1A
SCHEMBL30945489 0.69 KDM4E (0.50) ALDH1A1CHEK1PDGFRACDK5DYRK1A
SCHEMBL11652662 0.68 PARP15 (0.54) ALDH1A1TNKS2PARP2LMNARAB9A
SCHEMBL11649207 0.67 ALDH1A1 (0.50) ALDH1A1CHEK1PDGFRACDK5DYRK1A
SCHEMBL787056 0.67 TNKS2 (0.55) ALDH1A1CHEK1PDGFRACDK5DYRK1A

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
US-4075218-A INSECTICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1978-02-21 — — US claimed
US-3974286-A INSECTICIDES ELI LILLY AND COMPANY (US) 1976-08-10 — — US claimed
US-4075218-A INSECTICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1978-02-21 — — US disclosed
US-4075218-A INSECTICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1978-02-21 — — US disclosed
US-4075218-A INSECTICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1978-02-21 — — US disclosed
US-3974286-A INSECTICIDES ELI LILLY AND COMPANY (US) 1976-08-10 — — US disclosed
US-3974286-A INSECTICIDES ELI LILLY AND COMPANY (US) 1976-08-10 — — US disclosed
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