SCHEMBL6609628

SCHEMBL6609628

CCCCOc1cc(CCl)ncc1OC

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.41
PDE4A P27815 3/20 0.41
PDE4C Q08493 3/20 0.41
PDE4D Q08499 3/20 0.41
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
ENPP1 P22413 1/20 0.38
SMPD1 P17405 3/20 0.36
PRKCE Q02156 1/20 0.35
PRKCQ Q04759 1/20 0.35
PRKCD Q05655 1/20 0.35
TNF P01375 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
GAK O14976 1/20 0.34

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
SCHEMBL9915401 0.92 CYP1A2 (0.37) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL6608422 0.85 PDE4B (0.41) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL27278144 0.84 ALDH1A1 (0.41) ENPP1LMNAMAPT
Hydrochloric Acid SCHEMBL9687781 0.83 ALDH1A1 (0.43) LMNAMAPT
SCHEMBL6606573 0.80 PDE3B (0.36) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL6606565 0.80 ALDH1A1 (0.33) LMNAMAPT
SCHEMBL6606500 0.80 PDE4D (0.44) PDE4BPDE4APDE4CPDE4D
SCHEMBL9915311 0.78 CYP1A2 (0.37) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL6606792 0.78 SIGMAR1 (0.47)
SCHEMBL27508143 0.77 PDE4A (0.39) PDE4BPDE4APDE4CPDE4D

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
US-20170288269-A1 Modified Ionic Liquids Containing Phosphorus Sionic Energy, Inc. 2017-10-05 US disclosed
CN-1169792-C Substituted vinylpyridine derivatives and medicaments containing them ������ҩ��ʽ���� 2004-10-06 CN disclosed
EP-0882714-B1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS PHARMACEUTICAL CO (JP) 2004-03-03 EP disclosed
US-5935977-A PHOSPHODIESTERASE IV INHIBITORS, TUMOR NECROSIS FACTOR-ALPHA PRODUCTION INHIBITORS; TREATING INFLAMMATORY AND AUTOIMMUNE DISEASES SS PHARMACEUTICAL CO., LTD. (JP) 1999-08-10 US disclosed
CN-1206407-A Substituted vinylpyridine derivatives and medicaments containing them SS PHARMACEUTICAL CO (JP) 1999-01-27 CN disclosed
EP-0882714-A1 SUBSTITUTED VINYLPYRIDINE DERIVATIVES AND DRUGS CONTAINING THE SAME SS Pharmaceutical Co., Ltd. (JP) 1998-12-09 EP disclosed