SCHEMBL11147641

SCHEMBL11147641

CCOc1cccc(OCC)c1NC(=O)CN

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
TSHR P16473 2/20 0.47
CYP2C19 P33261 1/20 0.47
ADRA2C P18825 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GLA P06280 1/20 0.45
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MCL1 Q07820 1/20 0.44
HCRTR1 O43613 1/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KCNK3 O14649 1/20 0.43
KCNK9 Q9NPC2 1/20 0.43

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
SCHEMBL7444027 0.83 KDM4E (0.61) GAATSHRCYP2C19L3MBTL1GLA
SCHEMBL11330858 0.81 MAPT (0.55) GAACYP2C19L3MBTL1GLALMNA
SCHEMBL11142972 0.75 ALOX15 (0.58) TSHRCYP2C19LMNAPOLBKDM4E
SCHEMBL7289962 0.73 TDP1 (0.56) CYP2C19L3MBTL1LMNAKDM4EKMT2A
Glycinexylidide SCHEMBL4107220 0.73 LMNA (0.65) GAACYP2C19L3MBTL1LMNAPOLB
SCHEMBL9463141 0.72 SMN1; SMN2 (0.70) LMNASMN1; SMN2KDM4EKMT2AALDH1A1
SCHEMBL25086 0.72 POLB (0.80) TSHRLMNASMN1; SMN2POLBKDM4E
SCHEMBL11414687 0.70 POLB (0.61) GAALMNASMN1; SMN2POLBKDM4E
SCHEMBL16666142 0.69 GLA (0.52) GAATSHRL3MBTL1GLALMNA
SCHEMBL15145816 0.69 KMT2A (0.53) CYP2C19L3MBTL1LMNAKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4218477-A LONG LASTING ORAL AGENTS ASTRA PHARMACEUTICAL PRODUCTS, INC. (US) 1980-08-19 US claimed
US-4423059-A Fungicidal N-(pyrrolidinoacetyl)-anilines CIBA-GEIGY CORPORATION (US) 1983-12-27 US disclosed
US-4402953-A Fungicidal N-(morpholinoacetyl)-anilines, compositions and use CIBA-GEIGY CORPORATION (US) 1983-09-06 US disclosed
US-4349550-A Fungicidal N-(pyridazinoacetyl)-anilines CIBA-GEIGY CORPORATION (US) 1982-09-14 US disclosed
US-4244962-A FOR PLANTS CIBA-GEIGY CORPORATION (US) 1981-01-13 US disclosed
US-4207338-A PHYTOPATHOGENIC FUNGICIDES CIBA-GEIGY CORPORATION (US) 1980-06-10 US disclosed
US-4165381-A W-AMINO-ACYLANILIDES CIBA-GEIGY CORPORATION (US) 1979-08-21 US disclosed
US-4153712-A Pyrazolylacetanilide compounds and fungicidal compositions CIBA-GEIGY CORPORATION (US) 1979-05-08 US disclosed
US-4098895-A FUNGICIDES AND BACTERICIDES CIBA-GEIGY CORPORATION (US) 1978-07-04 US disclosed