SCHEMBL17849563

SCHEMBL17849563

Cc1ccc(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.59
FFAR4 Q5NUL3 1/20 0.59
ALDH1A1 P00352 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
UQCRB P14927 2/20 0.58
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
MAPT P10636 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C19 P33261 1/20 0.58
RORA P35398 1/20 0.57
PTPN5 P54829 1/20 0.55
PKM P14618 2/20 0.55
HDAC3 O15379 2/20 0.53
HDAC11 Q96DB2 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
IKBKB O14920 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
SCHEMBL20657540 0.84 FFAR4 (0.72) FFAR1FFAR4ALDH1A1MEN1KMT2A
SCHEMBL10013443 0.84 PTPN5 (0.68) FFAR1FFAR4ALDH1A1MEN1KMT2A
SCHEMBL17849569 0.83 MAPT (0.58) FFAR1FFAR4ALDH1A1MEN1KMT2A
SCHEMBL208685 0.83 UQCRB (0.67) ALDH1A1MEN1KMT2AUQCRBCA1
SCHEMBL5800778 0.82 FFAR4 (0.68) FFAR4ALDH1A1MEN1KMT2APKM
SCHEMBL812679 0.81 ALDH1A1 (0.83) FFAR1FFAR4ALDH1A1MEN1KMT2A
SCHEMBL27811906 0.80 ALDH1A1 (0.71) FFAR1FFAR4ALDH1A1MEN1KMT2A
SCHEMBL13433558 0.79 ALDH1A1 (0.73) ALDH1A1MEN1KMT2AUQCRBCA1
SCHEMBL1040954 0.79 ALDH1A1 (0.73) ALDH1A1MEN1KMT2AUQCRBCA1
SCHEMBL13615206 0.78 FFAR4 (0.60) FFAR1FFAR4ALDH1A1MEN1KMT2A

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-9371286-B2 Pharmaceutical composition with enhanced efficacy for inhibiting angiogenesis INDUSTRY-ACADEMIC COOPERATION FOUNDATION, YONSEI UNIVERSITY (KR) 2016-06-21 US disclosed