SCHEMBL8055430

SCHEMBL8055430

CN1CCC[C@H]1CNC(=O)Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.58
RAB9A P51151 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
HCRTR1 O43613 1/20 0.56
HCRTR2 O43614 1/20 0.56
ALDH1A1 P00352 2/20 0.55
BRD4 O60885 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MCHR1 Q99705 2/20 0.54
MCHR2 Q969V1 1/20 0.54
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
OPRM1 P35372 3/20 0.50
CHRNB2 P17787 1/20 0.50
CHRNA5 P30532 1/20 0.50
CHRNA7 P36544 1/20 0.50
CHRNA4 P43681 1/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50

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
SCHEMBL8049469 0.82 CTSL (0.67) RAB9AHCRTR1HCRTR2MCHR1MCHR2
SCHEMBL11240147 0.81 OPRM1 (0.46) ALDH1A1L3MBTL1OPRM1CHRNB2CHRNA5
SCHEMBL4956334 0.78 OPRD1 (0.59) EPHX1RAB9ASMN1; SMN2HCRTR1HCRTR2
SCHEMBL13162978 0.78 KAT2B (0.56) CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL7106481 0.78 KAT2B (0.56) CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL4443892 0.78 KAT2B (0.56) CHRNB2CHRNA5CHRNA7CHRNA4
SCHEMBL20056817 0.78 RAB9A (0.46) RAB9ASMN1; SMN2L3MBTL1MCHR1MCHR2
SCHEMBL12396182 0.77 OPRM1 (0.63) RAB9ASMN1; SMN2ALDH1A1MCHR1MCHR2
SCHEMBL29358366 0.76 CHRNB2 (0.44) RAB9ASMN1; SMN2ALDH1A1L3MBTL1OPRM1
SCHEMBL6223216 0.75 HCRTR1 (0.60) EPHX1RAB9ASMN1; SMN2HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8653282-B2 Preparation of dihydrothieno [3,2-D] pyrimidines and intermediates used therein BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-02-18 US disclosed
US-8114878-B2 6,7-dihydrothieno[3,2-d]pyrimidine for the treatment of inflammatory diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-02-14 US disclosed
US-8114878-B2 6,7-dihydrothieno[3,2-d]pyrimidine for the treatment of inflammatory diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-02-14 US disclosed
US-20100222585-A1 PREPARATION OF DIHYDROTHIENO [3, 2-D] PYRIMIDINES AND INTERMEDIATES USED THEREIN BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
WO-2009052138-A1 PREPARATION OF DIHYDROTHIENO [3, 2-D] PYRIMIDINES AND INTERMEDIATES USED THEREIN BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-23 WO disclosed
US-20080096882-A1 PDE4 (Phosphodiesterase) inhibitors; respiratory diseases, gastrointestinal diseases, inflammation the joints, skin or eyes, cancers, or diseases of the peripheral or central nervous system BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-04-24 US disclosed
WO-2007118793-A1 DIHYDROTHIENOPYRIMIDINE FOR TREATING INFLAMMATORY DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-25 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 (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-20080096882-A1 PDE4 (Phosphodiesterase) inhibitors; respiratory diseases, gastrointestinal diseases, inflammation the joints, skin or eyes, cancers, or diseases of the peripheral or central nervous system PDE4A, PDE4B, PDE12 EPHX1 227/4885RAB9A 2130/4885SMN1; SMN2 1736/4885
US-20100222585-A1 PREPARATION OF DIHYDROTHIENO [3, 2-D] PYRIMIDINES AND INTERMEDIATES USED THEREIN DPYD, TYMS, DHFR EPHX1 721/4885RAB9A 1919/4885SMN1; SMN2 1814/4885

“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.