SCHEMBL6616263

SCHEMBL6616263

COC(=O)N1CCN(c2ccc(Br)cn2)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.61
PANK3 Q9H999 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 1/20 0.50
CYP3A4 P08684 2/20 0.49
CYP2D6 P10635 2/20 0.49
HSD17B10 Q99714 2/20 0.49
TSHR P16473 1/20 0.49
CYP2C19 P33261 1/20 0.49
SMO Q99835 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
HRH3 Q9Y5N1 5/20 0.45

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
SCHEMBL8931657 0.86 SMN1; SMN2 (0.67) AKR1C3PANK3SMN1; SMN2HPGDHSD17B10
SCHEMBL30480343 0.85 AKR1C3 (0.57) AKR1C3PANK3SMN1; SMN2HPGDPPARG
SCHEMBL594352 0.85 AKR1C3 (0.57) AKR1C3PANK3SMN1; SMN2HPGDPPARG
SCHEMBL23600946 0.84 HRH3 (0.58) PANK3SMN1; SMN2HPGDCYP3A4CYP2D6
SCHEMBL29712339 0.84 AKR1C3 (0.56) AKR1C3PANK3SMN1; SMN2HPGDPPARG
SCHEMBL1433065 0.84 AKR1C3 (0.66) AKR1C3PANK3HPGDHSD17B10SMO
SCHEMBL30434376 0.84 AKR1C3 (0.66) AKR1C3PANK3HPGDHSD17B10SMO
SCHEMBL594698 0.82 AKR1C3 (0.52) AKR1C3PANK3SMN1; SMN2HPGDHSD17B10
SCHEMBL3208482 0.82 AKR1C3 (0.68) AKR1C3PANK3SMN1; SMN2HPGDHSD17B10
SCHEMBL594028 0.81 CKS1B (0.59) AKR1C3PANK3SMN1; SMN2HPGDKMT2A

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
EP-1289984-A4 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM CO LTD (KR) 2004-11-24 EP disclosed
US-6689779-B2 PYRIDINE OR PYRIMIDINE SUBSTITUTED; ANTIBACTERIAL ACTIVITY; LOW TOXICITY DONG A PHARM. CO., LTD. (KR) 2004-02-10 US disclosed
US-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof DONG A PHARM. CO., LTD. (KR) 2003-09-04 US disclosed
CN-1433413-A Oxazolidinone derivatives and process for their preparation DONG A PHARM CO LTD (KR) 2003-07-30 CN disclosed
EP-1289984-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF Dong A Pharmaceutical Co. Ltd. (KR) 2003-03-12 EP disclosed
WO-2001094342-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM. CO., LTD. (KR) 2001-12-13 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 (1 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-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof OXA1L, ODC1, PDCD4 AKR1C3 2366/4885PANK3 1849/4885SMN1; SMN2 3402/4885

“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.