SCHEMBL6713640

SCHEMBL6713640

O=C(NNc1nccs1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.71
RAB9A P51151 6/20 0.71
SCD O00767 1/20 0.68
KCNK3 O14649 1/20 0.58
KCNK9 Q9NPC2 1/20 0.58
LMNA P02545 5/20 0.55
KDM4E B2RXH2 2/20 0.55
ALDH1A1 P00352 2/20 0.55
GAA P10253 2/20 0.55
MAPT P10636 1/20 0.55
POLB P06746 1/20 0.55
HSPA5 P11021 1/20 0.54
HSPA9 P38646 1/20 0.54
CYP1A2 P05177 1/20 0.54
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
SMN1; SMN2 Q16637 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
METAP2 P50579 1/20 0.53
METAP1 P53582 1/20 0.53

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
SCHEMBL995829 0.83 NPC1 (1.00) NPC1RAB9ASCDKCNK3KCNK9
Hydrochloric Acid SCHEMBL27594584 0.82 NPC1 (0.97) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL16562033 0.81 SCD (1.00) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL27600813 0.79 NPC1 (0.50) NPC1RAB9ASCDALDH1A1MAPT
SCHEMBL11059973 0.78 RAB9A (0.77) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL4285954 0.77 NPC1 (0.85) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL4600878 0.76 NPC1 (0.73) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL14096340 0.76 NPC1 (0.73) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL26854309 0.76 NPC1 (0.73) NPC1RAB9ASCDKCNK3KCNK9
SCHEMBL27626566 0.76 GRIN2B (0.54) NPC1RAB9ALMNAKDM4EPOLB

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-20040043901-A1 Multilayer; support, heat sensitive element and protective coating FUJI PHOTO FILM CO., LTD. 2004-03-04 US disclosed
US-4254259-A HERBICIDES INDIANA UNIVERSITY FOUNDATION (US) 1981-03-03 US disclosed