SCHEMBL11652215

SCHEMBL11652215

Clc1ccc2sc3ncnn3c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 1/20 0.40
▸ TNKS2 Q9H2K2 1/20 0.40
▸ PARP2 Q9UGN5 1/20 0.40
▸ EGLN2 Q96KS0 4/20 0.37
▸ TMEM97 Q5BJF2 3/20 0.37
▸ CHEK1 O14757 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ DAPK3 O43293 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ MAP4K4 O95819 1/20 0.36
▸ ABL1 P00519 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ LCK P06239 1/20 0.36
▸ CSF1R P07333 1/20 0.36
▸ RET P07949 1/20 0.36
▸ MET P08581 1/20 0.36
▸ PDGFRB P09619 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ FGFR1 P11362 1/20 0.36
▸ PDGFRA P16234 1/20 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
SCHEMBL11656137 0.87 PARP2 (0.50) PARP15TNKS2PARP2EGLN2CHEK1
SCHEMBL11648560 0.80 HSP90AA1 (0.33) PARP15TNKS2PARP2MAP4K4DYRK1A
SCHEMBL11650673 0.80 PARP10 (0.50) PARP15TNKS2PARP2EGLN2KDM4E
SCHEMBL28173725 0.80 PIM1 (0.46) CHEK1AURKADAPK3JAK2MAP4K4
SCHEMBL11652353 0.75 ALDH1A1 (0.53) TNKS2PARP2CHEK1PDGFRADYRK1A
SCHEMBL11652422 0.67 PARP2 (0.54) PARP15TNKS2PARP2KDM4EALDH1A1
SCHEMBL16441919 0.64 RAB9A (0.48) KDM4EALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL406465 0.62 CUL4A (0.59) EGLN2CHEK1AURKADAPK3JAK2
SCHEMBL11737589 0.62 SMN1; SMN2 (0.46) CHEK1DYRK1ACLK4KDM4EALDH1A1
SCHEMBL23076418 0.62 RAB9A (0.47) PARP15TNKS2PARP2TMEM97KDM4E

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 2 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 disclosed
US-3974286-A INSECTICIDES ELI LILLY AND COMPANY (US) 1976-08-10 — — US disclosed
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