SCHEMBL8222003

SCHEMBL8222003

CC(C)(NC(=O)OCc1ccccc1)C1CCNCC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.54
ITGA2B P08514 4/20 0.54
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
ITGAV P06756 1/20 0.45
TSHR P16473 2/20 0.44
HTR2C P28335 1/20 0.43
CTSS P25774 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CPB1 P15086 1/20 0.43
LMNA P02545 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
SCHEMBL8138967 0.85 ALDH1A1 (0.62) ITGB3ITGA2BSMN1; SMN2MEN1KMT2A
SCHEMBL22233217 0.82 ITGB3 (0.57) ITGB3ITGA2BSMN1; SMN2MEN1KMT2A
SCHEMBL8142939 0.82 ALDH1A1 (0.50) ITGB3ITGA2BSMN1; SMN2MEN1KMT2A
SCHEMBL12070249 0.79 STS (0.53) SMN1; SMN2MEN1KMT2AGAANPC1
SCHEMBL2674008 0.78 KMT2A (0.47) KMT2A
SCHEMBL7617 0.77 ALDH1A1 (0.70) ITGB3ITGA2BMEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL605486 0.76 ALDH1A1 (0.68) ITGB3ITGA2BMEN1KMT2AALDH1A1
SCHEMBL8806297 0.76 MEN1 (0.51) SMN1; SMN2MEN1KMT2AALDH1A1GAA
SCHEMBL4442846 0.76 KMT2A (0.60) SMN1; SMN2MEN1KMT2AALDH1A1CTSS
SCHEMBL22372993 0.76 ALDH1A1 (0.60) ITGB3ITGA2BALDH1A1GAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503452-B2 Antimicrobial compounds and methods CURZA GLOBAL, LLC (US) 2025-12-23 US disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
EP-3911644-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed
US-8623857-B2 N-phenyl imidazole carboxamide inhibitors of 3-phosphoinositide-dependent protein kinase-1 MERCK SHARP & DOHME CORP. (US) 2014-01-07 US disclosed
US-8623857-B2 N-phenyl imidazole carboxamide inhibitors of 3-phosphoinositide-dependent protein kinase-1 MERCK SHARP & DOHME CORP. (US) 2014-01-07 US disclosed
US-20130079326-A1 N-PHENYL IMIDAZOLE CARBOXAMIDE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE-1 MERCK SHARP & DOHME CORP. 2013-03-28 US disclosed
US-20130079326-A1 N-PHENYL IMIDAZOLE CARBOXAMIDE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE-1 MERCK SHARP & DOHME CORP. 2013-03-28 US disclosed
US-8039467-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2011-10-18 US disclosed
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS SCHERING CORPORATION 2010-06-10 US disclosed
US-7652020-B2 novel hydantoin derivatives to inhibit matrix metalloproteinases (MMPs), a disintegrin and metalloproteases (ADAMs) and/or tumor necrosis factor alpha converting enzyme (TACE) and in so doing prevent the release of tumor necrosis factor alpha (TNF- alpha ); autoimmune diseases; side effect reduction SCHERING CORPORATION (US) 2010-01-26 US disclosed
US-7638513-B2 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION (US) 2009-12-29 US disclosed
US-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases SCHERING CORPORATION 2007-07-19 US disclosed
US-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases SCHERING CORPORATION 2007-07-19 US disclosed
WO-2007064749-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS AND MICROBIAL DISEASES SCHERING CORPORATION (US) 2007-06-07 WO disclosed
US-20060178366-A1 Compounds for the treatment of inflammatory disorders SCHERING CORPORATION 2006-08-10 US 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 (6 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-20070167426-A1 Compounds for the treatment of inflammatory disorders and microbial diseases MMP12, ADAMTS1, ADAM33 ITGB3 3809/4885ITGA2B 2824/4885SMN1; SMN2 2291/4885
US-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 ITGB3 4036/4885ITGA2B 4619/4885SMN1; SMN2 4817/4885
US-20060178366-A1 Compounds for the treatment of inflammatory disorders MMP12, ADAMTS1, TNF ITGB3 2316/4885ITGA2B 1687/4885SMN1; SMN2 1570/4885
US-20100145048-A1 COMPOUNDS FOR THE TREATMENT OF INFLAMMATORY DISORDERS TNF, MMP12, MMP8 ITGB3 1934/4885ITGA2B 1782/4885SMN1; SMN2 1401/4885
US-12503452-B2 Antimicrobial compounds and methods MPO, NISCH, RPN2 ITGB3 4036/4885ITGA2B 4619/4885SMN1; SMN2 4817/4885
US-20130079326-A1 N-PHENYL IMIDAZOLE CARBOXAMIDE INHIBITORS OF 3-PHOSPHOINOSITIDE-DEPENDENT PROTEIN KINASE-1 PDPK1, PDK1, PDK3 ITGB3 3956/4885ITGA2B 4364/4885SMN1; SMN2 3875/4885

“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.