SCHEMBL7745782

SCHEMBL7745782

CCCCC(CC)CCCCNS(=O)(=O)c1cc2ccccc2cc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.45
CA9 Q16790 3/20 0.45
RECQL P46063 1/20 0.44
CYP3A4 P08684 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
ALDH1A1 P00352 5/20 0.38
SCN1A P35498 2/20 0.38
SCN2A Q99250 2/20 0.38
SCN3A Q9NY46 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL4578926 0.88 ALDH1A1 (0.42) CA12CA9CYP3A4TSHRMEN1
SCHEMBL4579440 0.87 ALDH1A1 (0.45) CA12CA9RECQLCYP3A4TSHR
SCHEMBL6104327 0.79 ALDH1A1 (0.44) CYP3A4CYP1A2TSHRMEN1KMT2A
SCHEMBL4639897 0.78 LMNA (0.43) RECQLCYP3A4TSHRMEN1KMT2A
SCHEMBL6754471 0.77 CA1 (0.48) TSHRMEN1KMT2ALMNAPOLB
SCHEMBL6131283 0.72 CYP3A4 (0.53) RECQLCYP3A4TSHRMEN1KMT2A
SCHEMBL7111715 0.71 CA12 (0.67) CA12CA9RECQLCYP3A4CYP1A2
SCHEMBL4579438 0.71 LMNA (0.43) RECQLCYP3A4TSHRMEN1KMT2A
SCHEMBL9738489 0.70 CA12 (0.66) CA12CA9RECQLCYP3A4CYP1A2
SCHEMBL15294519 0.68 SLC6A9 (0.55) CYP3A4CYP1A2CYP2C19TSHRMEN1

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-6248497-B1 LIGHT SENSITIVE AND HEAT SENSITIVE RECORDING IMAGES FUJI PHOTO FILM CO., LTD. (JP) 2001-06-19 US disclosed
US-6245476-B1 SUPPORTS WITH DIAZO COMPOUNDS IN MICROCAPSULES FUJI PHOTO FILM CO., LTD. (JP) 2001-06-12 US disclosed