SCHEMBL3321300

SCHEMBL3321300

O=C1NC(=O)N2Cc3ccccc3CC12

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
CRBN Q96SW2 3/20 0.49
ADORA2A P29274 1/20 0.47
RAB9A P51151 1/20 0.46
HTT P42858 1/20 0.46
PARP1 P09874 1/20 0.45
SIGMAR1 Q99720 3/20 0.44
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40

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
SCHEMBL1398140 0.80 BRD4 (0.50) ALDH1A1CRBNRAB9ATSHRKDM4E
SCHEMBL9631384 0.76 CRBN (0.67) ALDH1A1CRBNADORA2ARAB9AHTT
SCHEMBL20811718 0.73 CRBN (0.76) ALDH1A1CRBNTSHR
SCHEMBL19359372 0.73 CRBN (0.73) ALDH1A1CRBNRAB9AHTTTSHR
SCHEMBL5652611 0.70 CRBN (0.67) ALDH1A1CRBNTSHR
SCHEMBL1398055 0.70 CRBN (0.46) ALDH1A1CRBNRAB9ATSHRKDM4E
SCHEMBL24569651 0.70 ADORA2A (0.46) ALDH1A1ADORA2ARAB9AHTTPARP1
SCHEMBL4627301 0.70 ADORA2A (0.46) ALDH1A1ADORA2ARAB9AHTTPARP1
SCHEMBL5720522 0.70 ADORA2A (0.46) ALDH1A1ADORA2ARAB9AHTTPARP1
SCHEMBL6856036 0.70 ADORA2A (0.46) ALDH1A1ADORA2ARAB9AHTTPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2144885-B1 IMIDAZOLIDINE CARBOXAMIDE DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS SANOFI SA (FR) 2016-06-29 EP disclosed
US-8735437-B2 Imidazolidine carboxamide derivatives as lipase and phospholipase inhibitors SANOFI (FR) 2014-05-27 US disclosed
EP-2492322-A1 Ink composition, image forming method, and printed material Fujifilm Corporation (JP) 2012-08-29 EP disclosed
US-20120213978-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-08-23 US disclosed
US-20100105719-A1 IMIDAZOLIDINE CARBOXAMIDE DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS SANOFI-AVENTIS (FR) 2010-04-29 US disclosed
EP-2144885-A1 IMIDAZOLIDINE CARBOXAMIDE DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS Sanofi-Aventis (FR) 2010-01-20 EP disclosed
WO-2008122352-A1 IMIDAZOLIDINE CARBOXAMIDE DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS SANOFI-AVENTIS (FR) 2008-10-16 WO disclosed
US-7192967-B1 Cyclic imide-substituted pyridylalkane, alkene, alkine carboxamides useful as cytostatic and immunosuppressive agents ASTELLAS PHARMA GMBH (DE) 2007-03-20 US disclosed
US-20070037807-A1 Pyridine compounds as inhibitors of dipeptidyl peptidase IV TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 US disclosed
EP-1042315-B1 CYCLIC IMIDE-SUBSTITUTED PYRIDYLALKANE, ALKENE, AND ALKINE CARBOXAMIDES USEFUL AS CYTOSTATIC AND IMMUNOSUPPRESSIVE AGENTS KLINGE CO CHEM PHARM FAB (DE) 2004-04-14 EP disclosed
US-4001245-A 2-[2-(Piperidino)ethyl]-10,10a-dihydro-1H,5H-imidazo[1,5-b]isoquinolin-1,3(2H)-dione MORTON-NORWICH PRODUCTS, INC. (US) 1977-01-04 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 (2 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-20070037807-A1 Pyridine compounds as inhibitors of dipeptidyl peptidase IV DPP4, DPP3, PEPD ALDH1A1 743/4885CRBN 2693/4885ADORA2A 3408/4885
US-20100105719-A1 IMIDAZOLIDINE CARBOXAMIDE DERIVATIVES AS LIPASE AND PHOSPHOLIPASE INHIBITORS PNLIP, PLD1, PLD2 ALDH1A1 577/4885CRBN 3738/4885ADORA2A 526/4885

“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.