SCHEMBL5536489

SCHEMBL5536489

Oc1ccccc1CCCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BID P55957 1/20 0.64
BCL2L1 Q07817 1/20 0.64
MCL1 Q07820 1/20 0.64
BAK1 Q16611 1/20 0.64
MPO P05164 5/20 0.62
IGF1R P08069 1/20 0.57
ALOX15 P16050 1/20 0.57
TAAR1 Q96RJ0 1/20 0.54
SLC6A4 P31645 1/20 0.53
MGLL Q99685 1/20 0.53
ACHE P22303 1/20 0.51
SGMS1 Q86VZ5 1/20 0.51
SGMS2 Q8NHU3 1/20 0.51
SLC6A5 Q9Y345 1/20 0.51
HSPA5 P11021 1/20 0.50
PKM P14618 1/20 0.50
MAOA P21397 1/20 0.50
MAPT P10636 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
MAOB P27338 1/20 0.48

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
SCHEMBL11064729 0.98 BID (0.67) BIDBCL2L1MCL1BAK1MPO
SCHEMBL5540327 0.98 BID (0.67) BIDBCL2L1MCL1BAK1MPO
SCHEMBL5544698 0.98 BID (0.67) BIDBCL2L1MCL1BAK1MPO
SCHEMBL8707379 0.98 BID (0.67) BIDBCL2L1MCL1BAK1MPO
SCHEMBL11097453 0.98 BID (0.67) BIDBCL2L1MCL1BAK1MPO
Chalcane SCHEMBL1238321 0.96 MPO (0.62) BIDBCL2L1MCL1BAK1MPO
SCHEMBL3800530 0.89 TAAR1 (0.65) MPOTAAR1SLC6A4MGLLHSPA5
Chalcane SCHEMBL27946134 0.87 MPO (0.54) BIDBCL2L1MCL1BAK1MPO
SCHEMBL987688 0.86 MPO (0.60) BIDBCL2L1MCL1BAK1MPO
SCHEMBL8401990 0.86 MGLL (0.66) BIDBCL2L1MCL1BAK1MPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
CN-100546963-C Method for synthesizing bisphenol GEN ELECTRIC (NL) 2009-10-07 CN disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
CN-1741979-A Process for the synthesis of bisphenol GEN ELECTRIC (US) 2006-03-01 CN disclosed
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed
US-20050203179-A1 Especially suitable for inhibiting the development of body odour in men CIBA SPECIALTY CHEMICALS CORP. 2005-09-15 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
CN-1044365-C Alpha, omega-diarylalkane derivatives, their preparation and their use in the treatment and prevention of circulatory diseases and psychosis SANKYO CO (JP) 1999-07-28 CN disclosed
EP-0844000-A1 Use of alpha, omega-diarylalkane derivatives in the treatment and prevention of psychosis SANKYO COMPANY LIMITED (JP) 1998-05-27 EP disclosed
CN-1137788-A Process for making polyphenols from ketones or aldehydes and phenols DOW CHEMICAL CO (US) 1996-12-11 CN disclosed
US-5556864-A TREATMENT OF CIRCULATORY DISEASES AND PSYCHOSIS SANKYO COMPANY, LIMITED (JP) 1996-09-17 US disclosed
CN-1102640-A Alpha, omega-diarylalkane derivatives, their preparation and their use in the treatment and prevention of circulatory and psychiatric disorders SANKYO CO (JP) 1995-05-17 CN disclosed
EP-0600717-A1 Phenoxyalkylamines, -pyrrolidines and -piperidines for the treatment and prevention of circulatory diseases and psychosis SANKYO COMPANY LIMITED (JP) 1994-06-08 EP 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-20050203179-A1 Especially suitable for inhibiting the development of body odour in men SRD5A1, SRD5A2, PON1 BID 4114/4885BCL2L1 4634/4885MCL1 4752/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 BID 4689/4885BCL2L1 2491/4885MCL1 3401/4885

“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.