SCHEMBL5572358

SCHEMBL5572358

CC([CH]Cc1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.46
TAAR1 Q96RJ0 2/20 0.40
SLC6A2 P23975 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2D6 P10635 2/20 0.38
CYP3A4 P08684 1/20 0.38
PRMT1 Q99873 1/20 0.38
MAPK1 P28482 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
ARG2 P78540 1/20 0.36
HIF1A Q16665 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
CALM1 P0DP23 1/20 0.35

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
SCHEMBL6745723 0.83 MAOB (0.46) MAOBTAAR1SLC6A2CYP1A2CYP2C19
SCHEMBL315315 0.79 MAOB (0.52) MAOBTAAR1SLC6A2CYP1A2CYP2D6
SCHEMBL10409227 0.74 MAOB (0.41) MAOBTAAR1SLC6A2CYP1A2CYP2C19
SCHEMBL9260781 0.71 HRH1 (0.40) SLC6A2MAPK1LMNA
SCHEMBL23524584 0.70 MAOB (0.52) MAOBTAAR1SLC6A2LMNATP53
SCHEMBL144711 0.70 MAOB (0.52) MAOBTAAR1SLC6A2TP53CA1
SCHEMBL4450792 0.67 MAPK1 (0.44) TAAR1CYP2C19CYP3A4MAPK1HIF1A
SCHEMBL28563681 0.67 ALDH1A1 (0.46) TAAR1CYP1A2CYP2C19CYP3A4MAPK1
SCHEMBL2121346 0.67 ESR1 (0.44) TAAR1CYP2C19CYP3A4MAPK1HIF1A
SCHEMBL8635078 0.67 TAAR1 (0.52) TAAR1SLC6A2CYP1A2CYP2C19CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150011588-A1 Novel formulation, omeprazole antacid complex-immediate release for rapid and sustained suppression of gastric acid BAUSCH & LOMB PHARMA HOLDINGS CORP. 2015-01-08 US disclosed
EP-1796641-A1 A NOVEL FORMULATION, OMEPRAZOLE ANTACID COMPLEX-IMMEDIATE RELEASE FOR RAPID AND SUSTAINED SUPPRESSION OF GASTRIC ACID Santarus, Inc. (US) 2007-06-20 EP disclosed
US-7019002-B2 Substituted on 8th position with benzoic acid, ester or amide groups; anticancer agents PHARMACIA & UPJOHN, S.P.A. (IT) 2006-03-28 US disclosed
WO-2006031256-A1 A NOVEL FORMULATION, OMEPRAZOLE ANTACID COMPLEX-IMMEDIATE RELEASE FOR RAPID AND SUSTAINED SUPPRESSION OF GASTRIC ACID SANTARUS, INC (US) 2006-03-23 WO disclosed
EP-1603537-A2 A NOVEL FORMULATION, OMEPRAZOLE ANTACID COMPLEX-IMMEDIATE RELEASE FOR RAPID AND SUSTAINED SUPRESSION OF GASTRIC ACID SANTARUS, INC. (US) 2005-12-14 EP disclosed
US-20050220870-A1 administering mixtures of proton pump inhibitors and buffers, used for prophylaxis of gastrointestinal disorders BAUSCH HEALTH MAGYARORSZAG KFT (A/K/A BAUSCH HEALTH HUNGARY LLC) (HU) 2005-10-06 US disclosed
US-20040248942-A1 Novel formulation, omeprazole antacid complex-immediate release for rapid and sustained suppression of gastric acid THE CURATORS OF THE UNIVERSITY OF MISSOURI 2004-12-09 US disclosed
WO-2004073654-A2 A NOVEL FORMULATION, OMEPRAZOLE ANTACID COMPLEX-IMMEDIATE RELEASE FOR RAPID AND SUSTAINED SUPRESSION OF GASTRIC ACID SANTARUS, INC. (US) 2004-09-02 WO disclosed
US-20040127539-A1 Antiangiogenic combination therapy for the treatment of cancer PHARMACIA CORPORATION 2004-07-01 US disclosed
EP-1414526-A2 ANTIANGIOGENIC COMBINATION THERAPY FOR THE TREATMENT OF CANCER Pharmacia Corporation (US) 2004-05-06 EP disclosed
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors PHARMACIA ITALIA S.P.A. 2004-01-15 US disclosed
US-20030087942-A1 Method for the treatment and prevention of cachexia WASHINGTON UNIVERSITY 2003-05-08 US disclosed
WO-2003020268-A1 METHOD FOR THE TREATMENT AND PREVENTION OF CACHEXIA WASHINGTON UNIVERSITY (US) 2003-03-13 WO disclosed
WO-2002085459-A2 ANTIANGIOGENIC COMBINATION THERAPY FOR THE TREATMENT OF CANCER PHARMACIA CORPORATION (US) 2002-10-31 WO disclosed
US-20020128232-A1 Heterocyclic angiogenesis inhibitors STARPHARMA LIMITED (AU) 2002-09-12 US disclosed
US-20020103141-A1 Antiangiogenic combination therapy for the treatment of cancer PHARMACIA CORPORATION 2002-08-01 US disclosed
WO-2002030886-A2 HETEROCYCLIC ANGIOGENESIS INHIBITORS MATTHEWS BARRY R (AU) 2002-04-18 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 (8 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-20050220870-A1 administering mixtures of proton pump inhibitors and buffers, used for prophylaxis of gastrointestinal disorders PGA5, SI, HRH2 MAOB 552/4885TAAR1 2892/4885SLC6A2 512/4885
US-20150011588-A1 Novel formulation, omeprazole antacid complex-immediate release for rapid and sustained suppression of gastric acid PGA5, GIPR, ATP6AP1 MAOB 905/4885TAAR1 2290/4885SLC6A2 248/4885
US-20020103141-A1 Antiangiogenic combination therapy for the treatment of cancer TOP2A, TOP2B, TOP1 MAOB 2195/4885TAAR1 4084/4885SLC6A2 2532/4885
US-20020128232-A1 Heterocyclic angiogenesis inhibitors KDR, CBR3, OGFR MAOB 599/4885TAAR1 453/4885SLC6A2 2494/4885
US-20030087942-A1 Method for the treatment and prevention of cachexia TNF, PTGES2, PTGS2 MAOB 2321/4885TAAR1 2522/4885SLC6A2 4265/4885
US-20040248942-A1 Novel formulation, omeprazole antacid complex-immediate release for rapid and sustained suppression of gastric acid PGA5, GIPR, ATP6AP1 MAOB 905/4885TAAR1 2290/4885SLC6A2 248/4885
US-20040127539-A1 Antiangiogenic combination therapy for the treatment of cancer TOP2A, TOP2B, TOP1 MAOB 2195/4885TAAR1 4084/4885SLC6A2 2532/4885
US-20040009993-A1 Pyridopyrimidinones derivatives as telomerase inhibitors TERT, TERF2, TERF2IP MAOB 3473/4885TAAR1 3873/4885SLC6A2 4839/4885

“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.