SCHEMBL6950321

SCHEMBL6950321

NC(=N/N=C/c1cccnc1)c1cnccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
TSHR P16473 1/20 0.40
MC4R P32245 1/20 0.40
ADRA1A P35348 1/20 0.40
MC3R P41968 1/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL6950318 1.00 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL6950327 1.00 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL6955960 0.83 NPC1 (0.49) ALDH1A1SMN1; SMN2RAB9ANPC1HPGD
SCHEMBL6955964 0.83 NPC1 (0.49) ALDH1A1SMN1; SMN2RAB9ANPC1HPGD
SCHEMBL6955970 0.83 NPC1 (0.49) ALDH1A1SMN1; SMN2RAB9ANPC1HPGD
SCHEMBL6960746 0.80 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL6960750 0.80 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL6960755 0.80 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2KMT2ARAB9ANPC1
SCHEMBL7717282 0.79 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL7717288 0.79 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1103549-B1 Photoprotective cosmetic compositions containing aminoamidine derivatives and uses thereof OREAL (FR) 2003-06-04 EP 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 claimed
EP-1103549-A1 Photoprotective cosmetic compositions containing aminoamidine derivatives and uses thereof L'OREAL (FR) 2001-05-30 EP claimed
EP-1103549-B1 Photoprotective cosmetic compositions containing aminoamidine derivatives and uses thereof OREAL (FR) 2003-06-04 EP disclosed
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