SCHEMBL170680

SCHEMBL170680

OC1c2ccccc2OCC1c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.58
LTB4R Q15722 2/20 0.55
LTB4R2 Q9NPC1 2/20 0.55
PARP3 Q9Y6F1 1/20 0.43
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
CYP19A1 P11511 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL30813009 1.00 CYP3A4 (0.58) CYP3A4LTB4RLTB4R2PARP3DRD2
SCHEMBL6093233 1.00 CYP3A4 (0.58) CYP3A4LTB4RLTB4R2PARP3DRD2
SCHEMBL2070162 1.00 CYP3A4 (0.58) CYP3A4LTB4RLTB4R2PARP3DRD2
SCHEMBL6093238 1.00 CYP3A4 (0.58) CYP3A4LTB4RLTB4R2PARP3DRD2
SCHEMBL14956962 1.00 CYP3A4 (0.58) CYP3A4LTB4RLTB4R2PARP3DRD2
SCHEMBL13268060 0.87 CYP3A4 (0.56) CYP3A4LTB4RLTB4R2DRD2DRD3
SCHEMBL17985005 0.87 CYP3A4 (0.60) CYP3A4LTB4RLTB4R2CYP19A1LMNA
SCHEMBL2069633 0.82 CYP3A4 (0.50) CYP3A4LTB4RLTB4R2MAOAMAOB
SCHEMBL2069344 0.82 CYP3A4 (0.50) CYP3A4LTB4RLTB4R2MAOAMAOB
SCHEMBL14198745 0.82 CYP3A4 (0.50) CYP3A4LTB4RLTB4R2MAOAMAOB

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 107 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103641808-B The enantioselective hydrogenation method of chromene GIRINDUS AMERICA INC. (US) 2016-04-20 CN claimed
CN-103755675-B The enantioselective hydrogenation method of chromene GIRINDUS AMERICA INC. (US) 2015-11-18 CN claimed
EP-1919887-B1 METHOD FOR ENANTIOSELECTIVE HYDROGENATION OF CHROMENES GIRINDUS AMERICA INC (US) 2015-02-18 EP claimed
US-8765420-B2 Method for preparing pterocarpan GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2014-07-01 US claimed
CN-101535286-B Process for the enantioselective hydrogenation of chromenes GIRINDUS AMERICA INC 2014-05-07 CN claimed
US-8716497-B2 Method for enantioselective hydrogenation of chromenes CHILDREN'S HOSPITAL MEDICAL CENTER (US) 2014-05-06 US claimed
CN-103755675-A Method for enantioselective hydrogenation of chromenes GIRINDUS AMERICA INC 2014-04-30 CN claimed
CN-103641808-A Method for enantioselective hydrogenation of chromenes GIRINDUS AMERICA INC 2014-03-19 CN claimed
US-20130130332-A1 NOVEL METHOD FOR PREPARING PTEROCARPAN GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2013-05-23 US claimed
US-20130116450-A1 METHOD FOR ENANTIOSELECTIVE HYDROGENATION OF CHROMENES GIRINDUS AMERICA, INC. (US) 2013-05-09 US claimed
JP-2007511542-A 2007-05-10 JP claimed
WO-2007016423-A2 METHOD FOR ENANTIOSELECTIVE HYDROGENATION OF CHROMENES GIRINDUS AMERICA INC. (US) 2007-02-08 WO claimed
US-20070027329-A1 Method for enantioselective hydrogenation of chromenes AUSIO PHARMACEUTICALS, LLC 2007-02-01 US claimed
CN-1902213-A Isoflavonoid prodrugs, compositions thereof and therapeutic methods involving same NOVOGEN RES PTY LTD (AU) 2007-01-24 CN claimed
CN-1902671-A English phonetic symbol system KUOJUI SU (US) 2007-01-24 CN claimed
WO-2006108212-A1 ANTI-INFLAMMATORY MODALITIES NOVOGEN RESEARCH PTY LTD (AU) 2006-10-19 WO claimed
EP-1685140-A1 ISOFLAVONOID PRODRUGS, COMPOSITIONS THEREOF AND THERAPEUTIC METHODS INVOLVING SAME Novogen Research Pty Ltd (AU) 2006-08-02 EP claimed
WO-2005103025-A1 ISOFLAVENE SYNTHETIC METHOD AND CATALYST NOVOGEN RESEARCH PTY LTD (AU) 2005-11-03 WO claimed
WO-2005049627-A1 ISOFLAVONOID PRODRUGS, COMPOSITIONS THEREOF AND THERAPEUTIC METHODS INVOLVING SAME NOVOGEN RESEARCH PTY LTD (AU) 2005-06-02 WO claimed
CN-1340048-A Production of isoflavone derivatives NOVOGEN RES PTY LTD (AU) 2002-03-13 CN claimed

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-20130116450-A1 METHOD FOR ENANTIOSELECTIVE HYDROGENATION OF CHROMENES HRH3, HRH2, CHD8 CYP3A4 487/4885LTB4R 3119/4885LTB4R2 2355/4885
US-20070027329-A1 Method for enantioselective hydrogenation of chromenes HRH3, HRH2, CHD8 CYP3A4 487/4885LTB4R 3119/4885LTB4R2 2355/4885

“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.