SCHEMBL7717290

SCHEMBL7717290

C/C(=N\N=C(N)c1ccc(O)cc1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ESR1 P03372 3/20 0.39
ESR2 Q92731 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NOS2 P35228 2/20 0.37
IDO1 P14902 1/20 0.37
TDO2 P48775 1/20 0.37
CYP2D6 P10635 1/20 0.36
HIF1A Q16665 1/20 0.36
KDM1A O60341 1/20 0.36
NPY1R P25929 2/20 0.36
NPY5R Q15761 1/20 0.36
CES2 O00748 1/20 0.34
NOS3 P29474 1/20 0.34

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
SCHEMBL7717293 1.00 LMNA (0.39) LMNAHSD17B10ESR1ESR2MEN1
SCHEMBL7717758 0.90 MEN1 (0.41) LMNAMEN1KMT2ANOS2CYP2D6
SCHEMBL7717755 0.90 MEN1 (0.41) LMNAMEN1KMT2ANOS2CYP2D6
SCHEMBL20017320 0.75 KDM1A (0.54) LMNAHSD17B10ESR1ESR2MEN1
SCHEMBL22043774 0.74 NOS3 (0.48) LMNAHSD17B10ESR1ESR2MEN1
SCHEMBL7717291 0.71 KDM1A (0.38) LMNAHSD17B10ESR1ESR2MEN1
SCHEMBL18938347 0.69 KMT2A (0.61) HSD17B10MEN1KMT2ACYP2D6HIF1A
SCHEMBL22044257 0.66 CYP2D6 (0.66) LMNAMEN1KMT2ACYP2D6HIF1A
SCHEMBL29506425 0.66 L3MBTL1 (0.41) LMNANOS2HIF1ANOS3
SCHEMBL28038711 0.65 KMT2A (0.54) LMNAHSD17B10ESR1ESR2MEN1

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-6379655-B1 FOR PROTECTION OF HUMAN SKIN AND/OR HAIR AGAINST THE DAMAGING EFFECTS OF ULTRAVIOLET IRRADIATION SOCIETE L'OREAL S.A. (FR) 2002-04-30 US claimed
US-6379655-B1 FOR PROTECTION OF HUMAN SKIN AND/OR HAIR AGAINST THE DAMAGING EFFECTS OF ULTRAVIOLET IRRADIATION SOCIETE L'OREAL S.A. (FR) 2002-04-30 US disclosed