SCHEMBL4607791

SCHEMBL4607791

CCc1cc2c(cc1C(C)=O)CC(NC(=O)C(F)(F)F)C2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APOB P04114 4/20 0.36
MTTP P55157 4/20 0.36
CA1 P00915 6/20 0.35
CA2 P00918 6/20 0.35
CA12 O43570 5/20 0.35
CA7 P43166 5/20 0.35
CA14 Q9ULX7 5/20 0.35
CA9 Q16790 4/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HSD17B1 P14061 1/20 0.33
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
DRD3 P35462 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL4124063 0.89 CA1 (0.39) CA1CA2CA12CA7CA14
SCHEMBL7860302 0.78 ELANE (0.39) APOBMTTPCA1CA2CA12
SCHEMBL865550 0.78 KDM4E (0.41) APOBMTTPCA1CA2CA12
SCHEMBL4607263 0.77 CA1 (0.43) CA1CA2CA12CA7CA14
SCHEMBL4607688 0.75 MAPT (0.45) APOBMTTPCA1CA2CA12
SCHEMBL19732112 0.75 HSD17B1 (0.40) ALDH1A1HSD17B1HTT
SCHEMBL21318768 0.75 HSD17B1 (0.40) KDM4EALDH1A1HSD17B1DRD2
SCHEMBL17513821 0.75 HSD17B1 (0.40) ALDH1A1HSD17B1HTT
SCHEMBL20444032 0.73 HSD17B1 (0.39) ALDH1A1HSD17B1
SCHEMBL20444031 0.73 HSD17B1 (0.39) ALDH1A1HSD17B1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487781-B1 PROCESS FOR PREPARING 2-AMINOINDAN DERIVATIVES NOVARTIS AG (CH) 2008-07-23 EP claimed
CN-1268605-C Process for preparing 2-aminoindan derivatives NOVARTIS AG (CH) 2006-08-09 CN claimed
US-6933410-B2 Process for preparing 5,6-diethyl-2,3-dihydro-1H-inden-2-amine NOVARTIS AG (CH) 2005-08-23 US claimed
CN-1639111-A Process for preparing 2-aminoindan derivatives NOVARTIS AG (CH) 2005-07-13 CN claimed
US-20030187301-A1 Process for preparing 5,6-diethyl-2,3-dihydro-1H-inden-2-amine NOVARTIS AG (CH) 2003-10-02 US claimed
EP-1487781-B1 PROCESS FOR PREPARING 2-AMINOINDAN DERIVATIVES NOVARTIS AG (CH) 2008-07-23 EP disclosed
EP-1487781-B1 PROCESS FOR PREPARING 2-AMINOINDAN DERIVATIVES NOVARTIS AG (CH) 2008-07-23 EP disclosed
CN-1268605-C Process for preparing 2-aminoindan derivatives NOVARTIS AG (CH) 2006-08-09 CN disclosed
US-6933410-B2 Process for preparing 5,6-diethyl-2,3-dihydro-1H-inden-2-amine NOVARTIS AG (CH) 2005-08-23 US disclosed
CN-1639111-A Process for preparing 2-aminoindan derivatives NOVARTIS AG (CH) 2005-07-13 CN disclosed
US-20030187301-A1 Process for preparing 5,6-diethyl-2,3-dihydro-1H-inden-2-amine NOVARTIS AG (CH) 2003-10-02 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 (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-20030187301-A1 Process for preparing 5,6-diethyl-2,3-dihydro-1H-inden-2-amine NAT1, AADAC, IDH3A APOB 1740/4885MTTP 3262/4885CA1 2153/4885

“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.