SCHEMBL10039342

SCHEMBL10039342

Cc1ccc(CCCS)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 3/20 0.35
RAB9A P51151 2/20 0.35
MEN1 O00255 2/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TNF P01375 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
CASP1 P29466 1/20 0.35
HBB P68871 1/20 0.35
NPC1 O15118 1/20 0.35
NR3C1 P04150 1/20 0.33

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
SCHEMBL9562607 0.92 PYCR1 (0.38) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL18242698 0.83 PYCR1 (0.40) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL6547406 0.82 TAAR1 (0.48) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL5838107 0.81 TYR (0.47) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL23654261 0.80 ALDH1A1 (0.45) TAAR1KDM4EALDH1A1KMT2AMEN1
SCHEMBL10875296 0.79 PYCR1 (0.40) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL1609492 0.79 PYCR1 (0.40) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL3903774 0.79 TAAR1 (0.53) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL30528049 0.79 PYCR1 (0.40) PYCR1TAAR1KDM4EALDH1A1TP53
SCHEMBL585307 0.79 TP53 (0.41) PYCR1TAAR1KDM4EALDH1A1TP53

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-2257809-B1 METHOD FOR IDENTIFYING INHIBITORS AGAINST VIRUSES THAT USE A CLASS I FUSION PROTEIN TIBOTEC PHARM LTD (IE) 2012-02-08 EP disclosed
EP-0081768-B1 COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1986-09-10 EP disclosed
US-4517286-A STABILITY FUJI PHOTO FILM CO., LTD. (JP) 1985-05-14 US disclosed
US-4483918-A CONTAINING 5-PYRAZOLONE MAGNETA COUPLER AND AROMATIC TERTIARY AMINE-DISCOLORATION INHIBITION FUJI PHOTO FILM CO., LTD. (JP) 1984-11-20 US disclosed
EP-0081768-A2 Color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1983-06-22 EP disclosed