SCHEMBL16683170

SCHEMBL16683170

CCC(C)c1ccc(C(=O)c2c(F)c(F)c(S(=O)(=O)O)c(C(F)(F)F)c2F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
TSHR P16473 2/20 0.33
AKR1C3 P42330 2/20 0.32
AKR1C2 P52895 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
KDM4E B2RXH2 1/20 0.31
CETP P11597 1/20 0.31
HDAC8 Q9BY41 2/20 0.31
HDAC6 Q9UBN7 2/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
USP2 O75604 1/20 0.30
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL16683122 0.95 ALDH1A1 (0.44) ALDH1A1TSHRAKR1C3AKR1C2MEN1
SCHEMBL16683157 0.89 ALDH1A1 (0.38) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683137 0.74 ALDH1A1 (0.41) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL9963769 0.73 ALDH1A1 (0.41) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683129 0.72 ALDH1A1 (0.39) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683153 0.71 MEN1 (0.48) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683143 0.71 ALDH1A1 (0.40) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683136 0.71 MEN1 (0.40) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL14962502 0.71 ALDH1A1 (0.56) ALDH1A1TSHRMEN1KMT2ANPSR1
SCHEMBL16683014 0.70 TDP1 (0.41) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150118628-A1 ACTINIC-RAY- OR RADIATION-SENSITIVE RESIN COMPOSITION, ACTINIC-RAY- OR RADIATION-SENSITIVE FILM THEREFROM, METHOD OF FORMING PATTERN, PROCESS FOR MANUFACTURING SEMICONDUCTOR DEVICE, AND SEMICONDUCTOR DEVICE FUJIFILM CORPORATION (JP) 2015-04-30 US disclosed