SCHEMBL3086802

SCHEMBL3086802

CC(C)(O)c1ccc(CNC(=O)c2cccnc2Oc2ccc(F)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.62
LMNA P02545 1/20 0.55
HPGD P15428 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KMT2A Q03164 1/20 0.54
PTGER4 P35408 2/20 0.53

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
SCHEMBL7678273 0.91 MAPK8 (0.58) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL7317640 0.90 MAPK8 (0.75) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL7368970 0.90 MAPK8 (0.60) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL5365002 0.90 MAPK8 (0.63) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL5608224 0.89 MAPK8 (0.52) MAPK8LMNAHPGDSMN1; SMN2PTGER4
SCHEMBL7403963 0.89 MAPK8 (0.59) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL7365815 0.89 MAPK8 (0.56) MAPK8LMNAHPGDSMN1; SMN2
SCHEMBL5365180 0.89 MAPK8 (0.59) MAPK8LMNAHPGDSMN1; SMN2KMT2A
SCHEMBL7367297 0.89 MAPK8 (0.61) MAPK8LMNAHPGDSMN1; SMN2
SCHEMBL5353948 0.88 MAPK8 (0.58) MAPK8LMNAHPGDSMN1; SMN2PTGER4

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050186276-A1 Pharmaceutical formulations PFIZER INC 2005-08-25 US claimed
US-20050154006-A1 Pharmaceutical compositions based on a scopineester and nicotinamide derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-07-14 US claimed
EP-1519711-A1 CONTROLLED-RELEASE PHARMACEUTICAL FORMULATIONS Pfizer Products Inc. (US) 2005-04-06 EP claimed
WO-2005007138-A1 PHARMACEUTICAL FORMULATIONS PFIZER PRODUCTS INC. (US) 2005-01-27 WO claimed
US-20040076668-A1 Controlled-release pharmaceutical formulations PFIZER INC. 2004-04-22 US claimed
WO-2004004684-A1 CONTROLLED-RELEASE PHARMACEUTICAL FORMULATIONS PFIZER PRODUCTS INC. (US) 2004-01-15 WO claimed
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN claimed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP claimed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO claimed
US-8883209-B2 Pharmaceutical solid dispersions BEND RESEARCH, INC. (US) 2014-11-11 US disclosed
US-8828442-B2 Pharmaceutical solid dispersions BEND RESEARCH, INC. (US) 2014-09-09 US disclosed
US-8481081-B2 Pharmaceutical solid dispersions BEND RESEARCH, INC. (US) 2013-07-09 US disclosed
US-20130029965-A1 PHARMACEUTICAL SOLID DISPERSIONS BEND RESEARCH, INC. (US) 2013-01-31 US disclosed
US-20100256110-A1 PHARMACEUTICAL SOLID DISPERSIONS PFIZER PRODUCTS INC. 2010-10-07 US disclosed
WO-2004004684-A1 CONTROLLED-RELEASE PHARMACEUTICAL FORMULATIONS PFIZER PRODUCTS INC. (US) 2004-01-15 WO disclosed
US-6380218-B1 FOR THERAPY OF RESPIRATORY, ALLERGIC, AND INFLAMMATORY DISORDERS COMPRISING ASTHMA, CHRONIC OBSTRUCTIVE PULMONARY DISEASE, ACUTE RESPIRATORY DISEASE SYNDROME, PULMONARY HYPERSENSITIVITY, AND ALLERGIC RHINITIS IN A MAMMAL PFIZER INC 2002-04-30 US disclosed
EP-1027886-A2 Pharmaceutical solid dispersions Pfizer Products Inc. (US) 2000-08-16 EP disclosed
CN-1254335-A Nicotinamide derivatives PFIZER PROD INC (US) 2000-05-24 CN disclosed
EP-0971894-A1 NICOTINAMIDE DERIVATIVES Pfizer Products Inc. (US) 2000-01-19 EP disclosed
WO-1998045268-A1 NICOTINAMIDE DERIVATIVES PFIZER PRODUCTS INC. (US) 1998-10-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050186276-A1 Pharmaceutical formulations PDE4A, PDE4B, PDE4D MAPK8 3621/4885LMNA 3900/4885HPGD 330/4885
US-20040076668-A1 Controlled-release pharmaceutical formulations PDE4A, PDE4B, PDE3B MAPK8 2334/4885LMNA 2462/4885HPGD 796/4885
US-20050154006-A1 Pharmaceutical compositions based on a scopineester and nicotinamide derivatives NAMPT, NNT, XDH MAPK8 2628/4885LMNA 1251/4885HPGD 98/4885
US-20100256110-A1 PHARMACEUTICAL SOLID DISPERSIONS ABCG2, ABCB11, CYP2C19 MAPK8 4132/4885LMNA 2253/4885HPGD 679/4885
US-20130029965-A1 PHARMACEUTICAL SOLID DISPERSIONS ABCG2, GRAMD1A, CYP2C19 MAPK8 3359/4885LMNA 2311/4885HPGD 1135/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.