SCHEMBL7792439

SCHEMBL7792439

COc1cccc(C2NC(C)(C)CO2)c1OC

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TSHR P16473 5/20 0.43
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP19A1 P11511 1/20 0.38
DRD2 P14416 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL16381560 0.86 DRD2 (0.46) KDM4ESMN1; SMN2ALDH1A1DRD2
SCHEMBL7796227 0.79 CHRNA1 (0.40) NPC1ALDH1A1
SCHEMBL7795756 0.77 CHRNA1 (0.46) KDM4ETSHRSMN1; SMN2ALDH1A1
SCHEMBL7786361 0.73 CYP19A1 (0.49) LMNAKDM4ETSHRGAASMN1; SMN2
SCHEMBL19002080 0.72 MEN1 (0.38) KDM4ETSHRNPC1SMN1; SMN2ALDH1A1
SCHEMBL9277221 0.71 SLC6A2 (0.39) ALDH1A1
SCHEMBL6302031 0.71 CHRNA1 (0.50) LMNAKDM4ENPC1GAADRD2
SCHEMBL10637412 0.71 CHRNA1 (0.33) ALDH1A1
SCHEMBL18555663 0.69 KDM4E (0.41) LMNAKDM4ETSHRGAASMN1; SMN2
SCHEMBL29639264 0.69 HTR2C (0.53) LMNAKDM4ETSHRGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1160309-C Alkyloxyamino substituted fluorenones and their use as protein kinase cinhibitors �ճ�˹�������³˹��˾ 2004-08-04 CN disclosed
EP-0906268-B1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS AVENTIS PHARMA INC (US) 2001-11-28 EP disclosed
US-6004959-A HYPOTENSIVE, ANTITUMOR, ANTIINFLAMMATORY AND ANTIASTHMATIC AGENTS; ANGIOGENESIS AND ALVEOLAR MACROPHAGE ACTIVATION INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-12-21 US disclosed
CN-1220660-A Alkyloxyamino substituted fluorenones and their use as protein kinase cinhibitors HOECHST MARION ROUSSEL INC (US) 1999-06-23 CN disclosed
EP-0906268-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1999-04-07 EP disclosed
WO-1997045397-A1 ALKYLOXYAMINO SUBSTITUTED FLUORENONES AND THEIR USE AS PROTEIN KINASE C INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-12-04 WO disclosed