SCHEMBL6961077

SCHEMBL6961077

N/C(=N\N=C\c1ccco1)c1cnccn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
ALDH1A1 P00352 5/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
MAPT P10636 2/20 0.49
CHIA Q9BZP6 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
KDM4E B2RXH2 2/20 0.44
CYP1A2 P05177 2/20 0.44
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 2/20 0.41
TP53 P04637 1/20 0.41
BAZ2B Q9UIF8 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
MC4R P32245 1/20 0.37
ADRA1A P35348 1/20 0.37

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
SCHEMBL6961085 1.00 POLB (0.62) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL6961080 1.00 POLB (0.62) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL7716547 0.85 ALDH1A1 (0.65) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL7716545 0.85 ALDH1A1 (0.65) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL7716550 0.85 ALDH1A1 (0.65) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL7717280 0.78 RAB9A (0.54) POLBALDH1A1NPC1RAB9AMAPT
SCHEMBL7717275 0.78 RAB9A (0.54) POLBALDH1A1NPC1RAB9AMAPT
SCHEMBL6952059 0.78 SMN1; SMN2 (0.47) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL6952053 0.78 SMN1; SMN2 (0.47) POLBALDH1A1L3MBTL1NPC1RAB9A
SCHEMBL6952055 0.78 SMN1; SMN2 (0.47) POLBALDH1A1L3MBTL1NPC1RAB9A

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 4 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
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
EP-1103549-A1 Photoprotective cosmetic compositions containing aminoamidine derivatives and uses thereof L'OREAL (FR) 2001-05-30 EP disclosed