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SCHEMBL2695321

SCHEMBL2695321

Cc1cc(C#N)cc(C(=O)NC(C)C2CC2)c1C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 3/20 0.41
▸ NPC1 O15118 2/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMYD3 Q9H7B4 4/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.37
▸ P2RX7 Q99572 2/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ RIPK1 Q13546 1/20 0.34
▸ CNR2 P34972 2/20 0.33
▸ IDO1 P14902 2/20 0.33
▸ EPHX2 P34913 1/20 0.33
▸ CCR8 P51685 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
SCHEMBL2696428 0.87 NPC1 (0.42) EGLN1NPC1RAB9ASMYD3IRAK4
SCHEMBL2693737 0.87 IRAK4 (0.37) EGLN1NPC1RAB9ASMYD3IRAK4
SCHEMBL2695326 0.85 EGLN1 (0.42) EGLN1NPC1RAB9ASMYD3IRAK4
SCHEMBL2695475 0.81 NPC1 (0.48) NPC1RAB9ASMYD3P2RX7JAK2
SCHEMBL3140934 0.78 EGLN1 (0.35) EGLN1
SCHEMBL2696430 0.77 NPC1 (0.44) EGLN1NPC1RAB9ASMYD3IRAK4
SCHEMBL2693742 0.77 IRAK4 (0.40) EGLN1NPC1RAB9ASMYD3IRAK4
SCHEMBL2905901 0.75 CXCR5 (0.34) —
SCHEMBL2780136 0.75 IRAK4 (0.41) EGLN1IRAK4
SCHEMBL2694672 0.73 NPC1 (0.52) NPC1RAB9ASMYD3P2RX7JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3646731-A1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2020-05-06 — — EP claimed
EP-3300602-B1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2020-03-25 — — EP claimed
EP-3300602-A1 PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2018-04-04 — — EP claimed
US-20160219872-A1 Foamable Pesticide Compositions And Methods Of Application BASF CORPORATION 2016-08-04 — — US claimed
US-9339030-B2 Foamable pesticide compositions and methods of application BASF CORPORATION (US) 2016-05-17 — — US claimed
EP-2864320-A1 PYRAZOLE COMPOUND AND PESTICIDAL MIXTURES COMPRISING A PYRAZOLE COMPOUND BASF SE (DE) 2015-04-29 — — EP claimed
US-20150105258-A1 Methods For Controlling Pests BASF CORPORATION (US) 2015-04-16 — — US claimed
US-8980294-B2 Methods for controlling pests BASF CORPORATION (US) 2015-03-17 — — US claimed
US-8940662-B2 Methods for controlling pests BASF CORPORATION (US) 2015-01-27 — — US claimed
WO-2014063942-A1 SUBSTITUTED PESTICIDAL PYRAZOLE COMPOUNDS BASF SE (DE) 2014-05-01 — — WO claimed
EP-2654424-A1 PESTICIDAL ACTIVE MIXTURES COMPRISING PYRAZOLE COMPOUNDS BASF SE (DE) 2013-10-30 — — EP claimed
WO-2013156318-A1 SUBSTITUTED PESTICIDAL PYRAZOLE COMPOUNDS BASF SE (DE) 2013-10-24 — — WO claimed
US-20130125267-A1 Pesticidal Mixtures BASF SE (DE) 2013-05-16 — — US claimed
EP-2575471-A1 PESTICIDAL MIXTURES BASF SE (DE) 2013-04-10 — — EP claimed
US-20130012386-A1 Methods For Controlling Pests BASF CORPORATION (US) 2013-01-10 — — US claimed
WO-2012084670-A1 PESTICIDAL ACTIVE MIXTURES COMPRISING PYRAZOLE COMPOUNDS BASF SE (DE) 2012-06-28 — — WO claimed
US-20120149570-A1 Foamable Pesticide Compositions And Methods Of Application BASF CORPORATION (US) 2012-06-14 — — US claimed
US-20100322892-A1 PESTICIDE COMPOSITIONS AND APPLICATORS BASF CORPORATION (US) 2010-12-23 — — US claimed
US-20100323897-A1 FOAMABLE PESTICIDE COMPOSITIONS BASF CORPORATION (US) 2010-12-23 — — US claimed
US-20100322990-A1 METHODS FOR CONTROLLING PESTS BASF CORPORATION (US) 2010-12-23 — — US claimed

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

For each of this compound's patents that has machine-readable text (8 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-20120149570-A1 Foamable Pesticide Compositions And Methods Of Application DDT, PLD1, ACHE EGLN1 1702/4885NPC1 1120/4885RAB9A 674/4885
US-20100323897-A1 FOAMABLE PESTICIDE COMPOSITIONS DDT, PON1, ACHE EGLN1 1382/4885NPC1 1318/4885RAB9A 1110/4885
US-20130012386-A1 Methods For Controlling Pests DDT, ACHE, PON1 EGLN1 1019/4885NPC1 627/4885RAB9A 557/4885
US-20130125267-A1 Pesticidal Mixtures DDT, CYP4B1, CYP4X1 EGLN1 930/4885NPC1 4332/4885RAB9A 934/4885
US-20100322990-A1 METHODS FOR CONTROLLING PESTS DDT, ACHE, PON1 EGLN1 1019/4885NPC1 627/4885RAB9A 557/4885
US-20100322892-A1 PESTICIDE COMPOSITIONS AND APPLICATORS DDT, ACHE, CHRM2 EGLN1 3248/4885NPC1 1127/4885RAB9A 2225/4885
US-20150105258-A1 Methods For Controlling Pests DDT, ACHE, PON1 EGLN1 1019/4885NPC1 627/4885RAB9A 557/4885
US-20160219872-A1 Foamable Pesticide Compositions And Methods Of Application DDT, PLD1, ACHE EGLN1 1702/4885NPC1 1120/4885RAB9A 674/4885

“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.