SCHEMBL7261981

SCHEMBL7261981

Cc1nnc(C)n1N=Cc1ccc(F)cc1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.68
KMT2A Q03164 3/20 0.68
ALDH1A1 P00352 9/20 0.65
KDM4E B2RXH2 4/20 0.65
CYP1A2 P05177 3/20 0.65
LMNA P02545 3/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C9 P11712 1/20 0.65
ATM Q13315 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
MAPK1 P28482 1/20 0.65
GLA P06280 1/20 0.61
HPGD P15428 3/20 0.53
MAPT P10636 1/20 0.48
HTT P42858 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.45
GAA P10253 1/20 0.44
ALOX12 P18054 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
SCHEMBL7261979 1.00 MEN1 (0.68) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL28530430 0.89 MEN1 (0.54) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL14706884 0.81 ALDH1A1 (0.70) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL7267427 0.81 KMT2A (0.62) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL7267424 0.81 KMT2A (0.62) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL7261903 0.80 CYP1A2 (0.71) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL7261906 0.80 CYP1A2 (0.71) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL3794295 0.74 CYP1A2 (0.59) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL28726342 0.74 MEN1 (0.57) MEN1KMT2AALDH1A1KDM4ECYP1A2
SCHEMBL3794301 0.74 CYP1A2 (0.59) MEN1KMT2AALDH1A1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6653353-B2 Hair styling anionic polymer and fluoroamines mixture improves the holding power of styling resins under high humidity conditions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2003-11-25 US disclosed
US-20020176834-A1 Cosmetic and personal care compositions UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-11-28 US disclosed