SCHEMBL880841

SCHEMBL880841

CCNc1ccc(F)cc1C

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
MAPT P10636 6/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAPK1 P28482 2/20 0.48
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
RECQL P46063 1/20 0.46
PIK3CA P42336 4/20 0.40
PIK3CG P48736 2/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL1643707 0.83 CYP3A4 (0.60) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL1116575 0.81 PKM (0.47) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL14838624 0.79 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL11548688 0.79 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL1948398 0.79 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL8348988 0.78 RAPGEF4 (0.52) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL12471164 0.78 KMT2A (0.43) KMT2AMEN1TDP1LMNAPOLB
SCHEMBL21763819 0.78 PKM (0.44) ALDH1A1MAPTKMT2AMEN1TDP1
SCHEMBL3631632 0.78 KMT2A (0.40) ALDH1A1MAPTKMT2AMEN1POLB
SCHEMBL30829688 0.78 ALDH1A1 (0.54) ALDH1A1MAPTLMNACYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10689331-B2 IDO inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2020-06-23 US disclosed
US-20190002402-A1 IDO INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-01-03 US disclosed
EP-1857443-B1 Therapeutic morpholino-substituted compounds ASTRAZENECA AB (SE) 2012-03-28 EP disclosed
US-7872011-B2 Inhibition of phosphoinositide 3-kinase β ASTRAZENECA AB (SE) 2011-01-18 US disclosed
US-7872011-B2 Inhibition of phosphoinositide 3-kinase β ASTRAZENECA AB (SE) 2011-01-18 US disclosed
US-7598377-B2 (+-)-7-Methyl-2-morpholin-4-yl-9-(1-phenylaminoethyl)-pyrido[1,2-a]pyrimidin-4-one, for example; selective inhibitors of phosphoinositide (PI) 3-kinase beta for use in anti-thrombotic therapy ASTRAZENECA AB (SE) 2009-10-06 US disclosed
US-7572791-B2 Therapeutic morpholino-substituted compounds ASTRAZENECA AB (SE) 2009-08-11 US disclosed
US-20080319021-A1 Inhibition Of Phosphoinositide 3-Kinase Beta KINACIA PTY. LTD. (AU) 2008-12-25 US disclosed
US-20080319021-A1 Inhibition Of Phosphoinositide 3-Kinase Beta KINACIA PTY. LTD. (AU) 2008-12-25 US disclosed
US-20080312233-A1 Therapeutic Morpholino-Substituted Compounds KINACIA PTY. LTD. (AU) 2008-12-18 US disclosed
US-20080206312-A1 Therapeutic Morpholino-Substituted Compounds KINACIA PTY. LTD. (AU) 2008-08-28 US disclosed
US-7405211-B2 Using 2-morpholinyl-4H-pyrido(1,2-a)pyrimidin-4-one; enzyme inhibitors; antithrombotic agents ; restenosis; atherosclerosis; antihistamines; chronic obsessive pulminary disease; autoimmune diseases; anticancer agents; antiinflammatory agents ASTRAZENECA AB (SE) 2008-07-29 US disclosed
EP-1257537-B1 THERAPEUTIC MORPHOLINO-SUBSTITUTED COMPOUNDS ASTRAZENECA AB (SE) 2007-05-30 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 (5 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-20080319021-A1 Inhibition Of Phosphoinositide 3-Kinase Beta PI4KB, PI4KA, PI4K2B ALDH1A1 4660/4885MAPT 4499/4885KMT2A 3584/4885
US-20080206312-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 ALDH1A1 4155/4885MAPT 3390/4885KMT2A 4098/4885
US-20080312233-A1 Therapeutic Morpholino-Substituted Compounds PIK3CA, PTK2, PDPK1 ALDH1A1 4155/4885MAPT 3390/4885KMT2A 4098/4885
US-20190002402-A1 IDO INHIBITORS IDO1, IDO2, INMT ALDH1A1 707/4885MAPT 1988/4885KMT2A 461/4885
US-10689331-B2 IDO inhibitors IDO1, IDO2, INMT ALDH1A1 707/4885MAPT 1988/4885KMT2A 461/4885

“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.