SCHEMBL2932998

SCHEMBL2932998

c1ccc(CC2N(Cc3ccccc3)CCN2Cc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.52
SIGMAR1 Q99720 1/20 0.50
TP53 P04637 1/20 0.47
MDM2 Q00987 1/20 0.47
ALDH1A1 P00352 1/20 0.45
ACHE P22303 1/20 0.44

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
SCHEMBL3301169 0.81 CCR3 (0.49) CCR3SIGMAR1ALDH1A1
SCHEMBL2933437 0.77 SIGMAR1 (0.51) SIGMAR1ALDH1A1
SCHEMBL6853109 0.76 CCR3 (0.53) CCR3
SCHEMBL13889205 0.76 CHRM2 (0.48) CCR3SIGMAR1ALDH1A1
SCHEMBL23802864 0.75
SCHEMBL819498 0.75 TP53 (0.70) SIGMAR1TP53MDM2ACHE
SCHEMBL11602359 0.75 SIGMAR1 (0.50) CCR3SIGMAR1TP53MDM2ALDH1A1
Water SCHEMBL11786514 0.75 ACHE (0.53) SIGMAR1TP53MDM2ACHE
SCHEMBL28360256 0.75
Hydrochloric Acid SCHEMBL11780582 0.75 ACHE (0.53) SIGMAR1TP53MDM2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101605765-B Controlled release of reactive aldehydes and ketones from an equilibrated dynamic mixture FIRMENICH & CIE 2012-06-06 CN claimed
EP-2114899-B1 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH & CIE (CH) 2010-09-22 EP claimed
US-20100098650-A1 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH SA (CH) 2010-04-22 US claimed
CN-101605765-A Controlled release of reactive aldehydes and ketones from an equilibrated dynamic mixture FIRMENICH & CIE (CH) 2009-12-16 CN claimed
EP-2114899-A2 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES Firmenich S.A. (CH) 2009-11-11 EP claimed
WO-2008093272-A2 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH SA (CH) 2008-08-07 WO claimed
CN-101605765-B Controlled release of reactive aldehydes and ketones from an equilibrated dynamic mixture FIRMENICH & CIE 2012-06-06 CN disclosed
EP-2114899-B1 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH & CIE (CH) 2010-09-22 EP disclosed
US-20100098650-A1 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH SA (CH) 2010-04-22 US disclosed
CN-101605765-A Controlled release of reactive aldehydes and ketones from an equilibrated dynamic mixture FIRMENICH & CIE (CH) 2009-12-16 CN disclosed
EP-2114899-A2 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES Firmenich S.A. (CH) 2009-11-11 EP disclosed
WO-2008093272-A2 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES FIRMENICH SA (CH) 2008-08-07 WO disclosed
CN-1169846-C Olefines polymerizing catalyst and use thereof 三井化学株式会社 2004-10-06 CN disclosed
CN-1239105-A Propene block copolymer and its preparing method MITSUI CHEMICALS INC (JP) 1999-12-22 CN disclosed
CN-1232829-A Olefin polymer catalyst and its use MITSUI CHEMICALS INC (JP) 1999-10-27 CN disclosed
CN-1231294-A Olefines polymerizing catalyst and use thereof MITSUI CHEMICALS INC (JP) 1999-10-13 CN disclosed
CN-1231295-A Propene polymer and preparation process thereof MITSUI CHEMICALS INC (JP) 1999-10-13 CN disclosed
CN-1231293-A Olefines polymerizing catalyst and use thereof MITSUI CHEMICALS INC (JP) 1999-10-13 CN disclosed
CN-1141304-A Solid titanium catalyst component, process for preparing same, olefin polymrization catalyst containing same, and olefin polymerization process MITSUI PETROCHEMICAL IND (JP) 1997-01-29 CN disclosed
CN-1111643-A Olefin polymerization catalyst and method for preparing polypropylene and propylene block polymer MITSUI PETROCHEMICAL IND (JP) 1995-11-15 CN 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 (1 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-20100098650-A1 CONTROLLED RELEASE OF ACTIVE ALDEHYDES AND KETONES FROM EQUILIBRATED DYNAMIC MIXTURES PKM, APEH, PLG CCR3 1621/4885SIGMAR1 576/4885TP53 3307/4885

“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.