SCHEMBL5203906

SCHEMBL5203906

CC(=O)NC1CCN(c2ccc(N)cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.50
GFER P55789 1/20 0.50
FPR1 P21462 1/20 0.50
FPR2 P25090 1/20 0.50
MTNR1A P48039 3/20 0.49
MTNR1B P49286 3/20 0.49
CCNC P24863 2/20 0.48
CDK8 P49336 2/20 0.48
AKT1 P31749 1/20 0.48
SMPD3 Q9NY59 1/20 0.46
EED O75530 2/20 0.45
DRD2 P14416 1/20 0.45
DRD3 P35462 1/20 0.45
CACNA2D1 P54289 1/20 0.44
SYK P43405 1/20 0.43
NAMPT P43490 2/20 0.43
ACACB O00763 1/20 0.43
MCHR1 Q99705 1/20 0.43

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
SCHEMBL3551660 1.00 CASP6 (0.50) CASP6GFERFPR1FPR2MTNR1A
SCHEMBL3551801 1.00 CASP6 (0.50) CASP6GFERFPR1FPR2MTNR1A
Hydrochloric Acid SCHEMBL5383077 0.98 FPR1 (0.49) CASP6GFERFPR1FPR2MTNR1A
Hydrochloric Acid SCHEMBL5406630 0.98 FPR1 (0.49) CASP6GFERFPR1FPR2MTNR1A
SCHEMBL13724538 0.91 GFER (0.57) CASP6GFEREEDDRD2DRD3
SCHEMBL20887685 0.88 ME3 (0.52) FPR1FPR2MTNR1AMTNR1BCCNC
SCHEMBL3714394 0.86 NAMPT (0.46) CASP6GFERMTNR1AMTNR1BNAMPT
SCHEMBL27258755 0.86 DRD2 (0.59) MTNR1AMTNR1BSMPD3DRD2DRD3
SCHEMBL3551387 0.82 MAPT (0.57)
SCHEMBL1749646 0.82 MAPT (0.57)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7179301-B2 Dyeing compositions for keratinous fibers containing paraphenylenediamine derivatives with pyrrolidinyl group L'OREAL S.A. (FR) 2007-02-20 US claimed
US-7179301-B2 Dyeing compositions for keratinous fibers containing paraphenylenediamine derivatives with pyrrolidinyl group L'OREAL S.A. (FR) 2007-02-20 US disclosed
US-7179301-B2 Dyeing compositions for keratinous fibers containing paraphenylenediamine derivatives with pyrrolidinyl group L'OREAL S.A. (FR) 2007-02-20 US disclosed
EP-1748999-A1 IMIDAZOLO-5-YL-2-ANILINOPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2007-02-07 EP disclosed
WO-2005075461-A1 IMIDAZOLO-5-YL-2-ANILINOPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2005-08-18 WO disclosed
EP-1200052-A2 DYEING COMPOSITIONS FOR KERATINOUS FIBRES CONTAINING PARAPHENYLENEDIAMINE DERIVATIVES WITH PYRROLIDINYL GROUP L'OREAL (FR) 2002-05-02 EP disclosed
WO-2001068043-A2 DYEING COMPOSITIONS FOR KERATINOUS FIBRES CONTAINING PARAPHENYLENEDIAMINE DERIVATIVES WITH PYRROLIDINYL GROUP L'OREAL (FR) 2001-09-20 WO disclosed