SCHEMBL11145541

SCHEMBL11145541

CC1CN1C(=O)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.54
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
POLB P06746 2/20 0.50
GRIN2B Q13224 2/20 0.50
TP53 P04637 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LIMK2 P53671 1/20 0.49
LMNA P02545 1/20 0.49
RBP4 P02753 1/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NAPRT Q6XQN6 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CACNA1H O95180 1/20 0.48
CACNA1C Q13936 1/20 0.48

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
SCHEMBL14749317 0.86 GRIN2B (0.59) NPC1RAB9ASMN1; SMN2GRIN2BTP53
SCHEMBL3709509 0.85 KDM4E (0.51) NPC1RAB9ASMN1; SMN2GRIN2BTP53
SCHEMBL26827904 0.83 MAPT (0.50) NPC1RAB9ASMN1; SMN2GRIN2BTP53
SCHEMBL23327023 0.82 NPC1 (0.55) NPC1RAB9ASMN1; SMN2POLBTP53
SCHEMBL31234028 0.82 SMN1; SMN2 (0.67) NPC1RAB9ASMN1; SMN2POLBTP53
SCHEMBL3714521 0.81 KDM4E (0.55) NPC1RAB9ASMN1; SMN2POLBGRIN2B
SCHEMBL29104577 0.81 KMT2A (0.51) NPC1RAB9ASMN1; SMN2POLBKDM4E
SCHEMBL7893585 0.80 NAMPT (0.51) KDM4ELIMK2RBP4
SCHEMBL26817847 0.80 NAMPT (0.48) NPC1RAB9ASMN1; SMN2TP53KDM4E
SCHEMBL14638491 0.80 NAMPT (0.56) NPC1RAB9ASMN1; SMN2TP53KDM4E

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-4407939-A GELATIN MODIFIED WITH SUCCINIC, PHTHALIC OR TRIMELLITIC ANHYDRIDE POSITIONED BETWEEN FUJI PHOTO FILM CO., LTD. (JP) 1983-10-04 US disclosed
US-4021245-A GELATION DERIVATIVE, SILICIC ACID ANHYDRIDE FUJI PHOTO FILM CO., LTD. (JA) 1977-05-03 US disclosed