SCHEMBL9354701

SCHEMBL9354701

C=CCNC(=O)c1cc(-c2c(C(F)(F)F)n(C)c(=O)[nH]c2=O)cc(C(=O)OCC)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.35
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 2/20 0.34
RAB9A P51151 1/20 0.34
BAZ2B Q9UIF8 1/20 0.34
BAZ2A Q9UIF9 1/20 0.34
TK1 P04183 1/20 0.34
PKM P14618 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GAA P10253 2/20 0.33
TRPC1 P48995 1/20 0.33
TRPC3 Q13507 1/20 0.33
STIM1 Q13586 1/20 0.33
ORAI1 Q96D31 1/20 0.33
STIM2 Q9P246 1/20 0.33
CYP1A2 P05177 2/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL6219140 0.72 BAZ2B (0.41) HPGDALDH1A1KDM4EBAZ2BBAZ2A
SCHEMBL5174653 0.69 GSK3A (0.36) HPGDALDH1A1KDM4ETDP1POLB
SCHEMBL6545351 0.67 THRA (0.32)
SCHEMBL9359135 0.66 GRIK1 (0.50) ALDH1A1KDM4ETDP1GAAPOLB
SCHEMBL6219513 0.59 GRIK1 (0.33) ALDH1A1POLBKMT2ALMNA
SCHEMBL6217982 0.59 LMNA (0.31) POLBKMT2ALMNA
SCHEMBL3081420 0.58 HPGD (0.41) HPGDALDH1A1RAB9ACYP1A2POLB
SCHEMBL16415499 0.57 TSHR (0.47) HPGDALDH1A1KDM4ERAB9ABAZ2B
SCHEMBL8908156 0.57 BCAT2 (0.43) HPGDALDH1A1KDM4ERAB9APKM
SCHEMBL4218274 0.56 KDM4E (0.46) HPGDALDH1A1KDM4ERAB9ATDP1

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
EP-0618908-A1 3-ARYLURACIL DERIVATIVES AND THE USE THEREOF FOR WEED CONTROL CIBA-GEIGY AG (CH) 1994-10-12 EP disclosed