SCHEMBL87329

SCHEMBL87329

C=CC(=O)NCCCN(C)C.C=CN1CCCC1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 1/20 0.41
KDM4E B2RXH2 3/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 5/20 0.37
MAPT P10636 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 2/20 0.36
HPGD P15428 1/20 0.35
GFER P55789 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TGM2 P21980 3/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 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
SCHEMBL9320685 0.95 ZDHHC20 (0.43) RAD52KDM4EZDHHC20ZDHHC2CYP1A2
SCHEMBL83920 0.86 RAD52 (0.44) RAD52KDM4ECYP1A2ALDH1A1MAPT
SCHEMBL9321561 0.85 ZDHHC20 (0.42) KDM4EZDHHC20ZDHHC2CYP1A2ALDH1A1
SCHEMBL9176002 0.80 BRD4 (0.36) TSHR
Urea SCHEMBL27513933 0.79 TSHR (0.46) ALDH1A1TSHRTGM2KMT2A
SCHEMBL27790589 0.78 ZDHHC20 (0.58) KDM4EZDHHC20ZDHHC2ALDH1A1TSHR
SCHEMBL21611 0.78 ZDHHC20 (0.58) KDM4EZDHHC20ZDHHC2ALDH1A1TSHR
SCHEMBL9126544 0.78 TSHR (0.35) ALDH1A1TSHRTGM2KMT2A
SCHEMBL27680447 0.77 TSHR (0.43) ZDHHC20ZDHHC2ALDH1A1TSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL131505 0.77 ZDHHC20 (0.56) KDM4EZDHHC20ZDHHC2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130059917-A1 MODIFIED RELEASE DOSAGE FORM COMPRISING DESVENLAFAXINE OR SALTS THEREOF JAIN GIRISH KUMAR (IN) 2013-03-07 US claimed
EP-2552419-A2 MODIFIED RELEASE DOSAGE FORM COMPRISING DESVENLAFAXINE OR SALTS THEREOF Wockhardt Limited (IN) 2013-02-06 EP claimed
WO-2011121475-A2 MODIFIED RELEASE DOSAGE FORM COMPRISING DESVENLAFAXINE OR SALTS THEREOF WOCKHARDT LIMITED (IN) 2011-10-06 WO claimed
US-20100234288-A1 SUSTAINED RELEASE PHARMACEUTICAL COMPOSITION ON THE BASIS OF RELEASE SYSTEM COMPRISING AN ACID-SOLUBLE POLYMER AND A pH-DEPENDENT POLYMER PANACEA BIOTEC LTD (IN) 2010-09-16 US claimed
US-20100056493-A1 MODIFIED RELEASE PHARMACEUTICAL COMPOSITION AND A PROCESS OF MAKING THE SAME PANACEA BIOTEC LIMITED (IN) 2010-03-04 US claimed
EP-2114380-A1 MODIFIED RELEASE PHARMACEUTICAL COMPOSITION AND A PROCESS OF MAKING THE SAME Panacea Biotec Ltd. (IN) 2009-11-11 EP claimed
WO-2009118763-A1 MULTILAYERED PHARMACEUTICAL COMPOSITIONS AND PROCESSES THEREOF PANACEA BIOTEC LIMITED (IN) 2009-10-01 WO claimed
US-20090099154-A1 Pharmaceutical Sustained Release Compositions and Processes Thereof PANACEA BIOTEC LTD. (IN) 2009-04-16 US claimed
EP-2004150-A1 SUSTAINED RELEASE PHARMACEUTICAL COMPOSITION ON THE BASIS OF A RELEASE SYSTEM COMPRISING AN ACID-SOLUBLE POLYMER AND A PH-DEPENDENT POLYMER. Panacea Biotec Ltd. (IN) 2008-12-24 EP claimed
WO-2008122993-A1 CONTROLLED RELEASE FORMULATION OF COATED MICROPARTICLES PANACEA BIOTEC LIMITED (IN) 2008-10-16 WO claimed
US-6828293-B1 Suitable catalysts for oxidations with peroxy compounds, especially within the context of washing procedures CIBA SPECIALTY CHEMICALS CORPORATION 2004-12-07 US claimed
US-6825162-B2 PARTICLES COMPRISING A SALDIMINE-TYPE MANGANESE COMPLEX AND AT LEAST 10% BY WEIGHT OF A POLYMERIC DISSOLUTION RESTRAINER PROVIDE BETTER INHIBITION OF THE REDEPOSITION OF MIGRATING DYES IN WASHING LIQUORS THAN BY PURE MANGANESE COMPLEX CIBA SPECIALTY CHEMICALS CORPORATION 2004-11-30 US claimed
EP-0959123-B1 Water soluble granulate of phthalocyanine compounds CIBA SC HOLDING AG (CH) 2004-07-28 EP claimed
US-20040142842-A1 Process for the preparation of water-soluble granules or particles of saldimine-type manganese complexes CIBA SPECIALTY CHEMICALS CORP. 2004-07-22 US claimed
WO-2004022693-A1 FORMULATIONS COMPRISING WATER-SOLUBLE GRANULATES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-03-18 WO claimed
EP-1354025-A1 PROCESS FOR THE PREPARATION OF WATER-SOLUBLE GRANULES OR PARTICLES OF SALDIMINE-TYPE MANGANESE COMPLEXES Ciba SC Holding AG (CH) 2003-10-22 EP claimed
WO-2002059245-A1 PROCESS FOR THE PREPARATION OF WATER-SOLUBLE GRANULES OR PARTICLES OF SALDIMINE-TYPE MANGANESE COMPLEXES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-08-01 WO claimed
EP-1200545-A1 WATER-SOLUBLE GRANULES OF SALEN-TYPE MANGANESE COMPLEXES Ciba SC Holding AG (CH) 2002-05-02 EP claimed
US-6291412-B1 ADDITIVES TO WASHING AGENTS FOR TEXTILE MATERIALS. ANIONIC DISPERSING AGENT, CIBA SPECIALTY CHEMICALS CORPORATION 2001-09-18 US claimed
WO-2001009276-A1 WATER-SOLUBLE GRANULES OF SALEN-TYPE MANGANESE COMPLEXES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2001-02-08 WO 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 (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-20130059917-A1 MODIFIED RELEASE DOSAGE FORM COMPRISING DESVENLAFAXINE OR SALTS THEREOF CYP2D6, SLC6A4, SLC6A2 RAD52 3760/4885KDM4E 1493/4885ZDHHC20 3701/4885

“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.