SCHEMBL7754250

SCHEMBL7754250

C=C(C)C(=O)Nc1ccc(C)cc1N=S(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ TDP1 Q9NUW8 2/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ RXFP1 Q9HBX9 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ RAB9A P51151 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TP53 P04637 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
SCHEMBL9702645 0.81 NPC1 (0.43) HPGDGAATDP1RXFP1POLB
SCHEMBL5082956 0.77 KMT2A (0.61) HPGDGAAMEN1KMT2ATHRB
SCHEMBL14354726 0.75 KCNMA1 (0.55) GAAMEN1KMT2APOLBSMN1; SMN2
SCHEMBL7613675 0.75 HPGD (0.39) HPGDGAACYP1A2CYP2C9CYP2C19
SCHEMBL2264127 0.74 RAB9A (0.55) HPGDGAAMEN1KMT2ARXFP1
SCHEMBL4252456 0.72 NPC1 (0.45) HPGDGAATDP1RXFP1POLB
SCHEMBL1813969 0.71 TDP1 (0.43) HPGDGAACYP1A2CYP2C9CYP2C19
SCHEMBL21281597 0.71 HPGD (0.39) HPGDGAACYP1A2CYP2C9CYP2C19
SCHEMBL13756114 0.71 JAK3 (0.46) HPGDGAACYP1A2CYP2C9CYP2C19
SCHEMBL19268080 0.70 NPSR1 (0.44) HPGDGAATDP1KMT2APOLB

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-1077392-A1 Photosensitive lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 2001-02-21 — — EP disclosed
Send feedback