SCHEMBL6329461

SCHEMBL6329461

CON(C)C(=O)c1cc2c(Cl)cccc2s1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.57
HDAC4 P56524 2/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC7 Q8WUI4 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC10 Q969S8 2/20 0.57
HDAC11 Q96DB2 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
HDAC9 Q9UKV0 2/20 0.57
HDAC5 Q9UQL6 2/20 0.57
SLC9A1 P19634 6/20 0.52
CLK1 P49759 6/20 0.52
DYRK1A Q13627 2/20 0.52
DYRK1B Q9Y463 1/20 0.52
ICAM1 P05362 2/20 0.46
SELE P16581 2/20 0.46
ALOX5 P09917 1/20 0.45
CLK2 P49760 2/20 0.41
SLC22A12 Q96S37 1/20 0.39

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
SCHEMBL6330056 0.87 CLK1 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5584929 0.84 CLK1 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6089315 0.84 CLK1 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL828439 0.80 HDAC3 (0.68) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6329338 0.78 HDAC3 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6329351 0.77 HDAC3 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11888470 0.77 CLK1 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL699799 0.76 HDAC3 (0.71) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17267450 0.76 HDAC3 (0.71) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29485573 0.76 HDAC3 (0.71) HDAC3HDAC4HDAC1HDAC7HDAC2

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9255111-B2 Parasiticidal dihydroisoxazole compounds ELI LILLY AND COMPANY (US) 2016-02-09 US disclosed
US-9255111-B2 Parasiticidal dihydroisoxazole compounds ELI LILLY AND COMPANY (US) 2016-02-09 US disclosed
EP-2918583-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND CO. (US) 2015-09-16 EP disclosed
EP-2918583-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND CO. (US) 2015-09-16 EP disclosed
EP-2710000-B1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS LILLY CO ELI (US) 2015-04-29 EP disclosed
EP-2710000-B1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS LILLY CO ELI (US) 2015-04-29 EP disclosed
US-20150072993-A1 Parasiticidal Dihydroisoxazole Compounds JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2015-03-12 US disclosed
US-20150072993-A1 Parasiticidal Dihydroisoxazole Compounds JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2015-03-12 US disclosed
US-20150072993-A1 Parasiticidal Dihydroisoxazole Compounds JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2015-03-12 US disclosed
US-8889710-B2 Parasiticidal dihydroisoxazole compounds ELI LILLY AND COMPANY (US) 2014-11-18 US disclosed
US-20130217699-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2013-08-22 US disclosed
US-20130217699-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2013-08-22 US disclosed
WO-2012155352-A1 DIHYDROISOXAZOLE COMPOUNDS, PARASITICIDAL USES AND FORMULATIONS THEREOF ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012155352-A1 DIHYDROISOXAZOLE COMPOUNDS, PARASITICIDAL USES AND FORMULATIONS THEREOF ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012155676-A1 PARASITICIDAL COMPOUNDS, METHODS, AND FORMULATIONS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012155676-A1 PARASITICIDAL COMPOUNDS, METHODS, AND FORMULATIONS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012158396-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
WO-2012158396-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-11-22 WO disclosed
US-6900216-B2 Dihydroimidazo[2,1-b]thiazole and dihydro-5h-thiazolo[3,2-A]pyrimidines as antidepressant agents KNOLL GMBH (DE) 2005-05-31 US disclosed
US-20030166628-A1 Dihydroimidazo[2,1-b]thiazole and dihydro-5h-thiazolo[3,2-A]pyrimidines as antidepressant agents KNOLL GMBH (DE) 2003-09-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130217699-A1 PARASITICIDAL DIHYDROISOXAZOLE COMPOUNDS DHODH, DDT, CYP51A1 HDAC3 418/4885HDAC4 941/4885HDAC1 797/4885
US-20150072993-A1 Parasiticidal Dihydroisoxazole Compounds DHODH, DDT, CYP51A1 HDAC3 332/4885HDAC4 831/4885HDAC1 674/4885
US-20030166628-A1 Dihydroimidazo[2,1-b]thiazole and dihydro-5h-thiazolo[3,2-A]pyrimidines as antidepressant agents GPR119, HTR3B, HTR2B HDAC3 1924/4885HDAC4 1852/4885HDAC1 1492/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.