SCHEMBL20198520

SCHEMBL20198520

O=C(Nc1cc(F)ccc1N1CCCCC1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 6/20 0.72
TDP1 Q9NUW8 1/20 0.72
TSHR P16473 3/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
MAPK1 P28482 1/20 0.71
KMT2A Q03164 7/20 0.67
ALDH1A1 P00352 6/20 0.67
HPGD P15428 4/20 0.67
MAPT P10636 4/20 0.65
USP2 O75604 1/20 0.62
HSD17B10 Q99714 1/20 0.62
BRPF1 P55201 1/20 0.61
TP53 P04637 1/20 0.58
KDM4E B2RXH2 2/20 0.58
LMNA P02545 2/20 0.58
MEN1 O00255 4/20 0.57
KDR P35968 1/20 0.57
SRPK2 P78362 1/20 0.57
SRPK1 Q96SB4 1/20 0.57
SRPK3 Q9UPE1 1/20 0.57

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
SCHEMBL22700680 0.87 SRPK1 (0.74) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL3485720 0.87 SRPK1 (0.74) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL31187476 0.87 SRPK1 (0.74) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL12765717 0.85 SRPK1 (0.78) NPSR1TSHRSMN1; SMN2KMT2AALDH1A1
SCHEMBL3485129 0.85 SRPK1 (0.78) NPSR1TSHRSMN1; SMN2KMT2AALDH1A1
SCHEMBL20198469 0.84 KMT2A (0.72) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL16697303 0.81 MAPT (0.64) NPSR1TDP1TSHRSMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL2023240 0.80 POLB (0.76) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL23196345 0.78 MAPT (0.52) NPSR1TDP1TSHRSMN1; SMN2MAPK1
SCHEMBL29937951 0.78 HRH3 (0.61) NPSR1TDP1SMN1; SMN2KMT2AALDH1A1

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-1712242-B1 METHOD OF REGULATING PHOSPHORYLATION OF SR PROTEIN AND ANTIVIRAL AGENTS COMPRISING SR PROTEIN ACTIVITY REGULATOR AS THE ACTIVE INGREDIENT HAGIWARA MASATOSHI (JP) 2018-05-30 EP disclosed