SCHEMBL241702

SCHEMBL241702

O=[PH](c1ccccc1)c1ccc2c(c1[PH](=O)c1ccccc1)NC(c1cccc3ccccc13)CC2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
MTNR1A P48039 1/20 0.36
IDO1 P14902 1/20 0.33
PLA2G6 O60733 4/20 0.32
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
FAAH O00519 1/20 0.32
NPC1 O15118 1/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
MTOR P42345 1/20 0.32
RAB9A P51151 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL238382 0.72 CYP2C9 (0.37) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL28905026 0.70 AR (0.42) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL242551 0.69 TOP1 (0.43) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL8768310 0.66 IDO1 (0.43) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL8543004 0.65 MTNR1A (0.48) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL8544148 0.64 MTNR1A (0.47) CYP1A2CYP2D6CYP2C9CYP2C19HIF1A
SCHEMBL29144902 0.64 MTNR1A (0.45) MTNR1AIDO1PLA2G6MAPK1ALDH1A1
SCHEMBL5440135 0.63 NR4A1 (0.41) CYP1A2CYP2D6CYP2C9CYP2C19ALDH1A1
SCHEMBL5083830 0.62 IDO1 (0.58) MTNR1AIDO1PLA2G6MAPK1ALDH1A1
SCHEMBL240805 0.61 MTNR1A (0.32) MTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735583-B2 Chiral phosphorus compound JOHNSON MATTHEY PUBLIC LIMITED CO. (GB) 2014-05-27 US disclosed
US-20130150583-A1 CHIRAL PHOSPHORUS COMPOUND JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2013-06-13 US disclosed
US-8404843-B2 Chiral phosphorus compound JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2013-03-26 US disclosed
US-20120264940-A1 CHIRAL PHOSPHORUS COMPOUND JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2012-10-18 US disclosed
US-8222415-B2 Chiral phosphorus compound JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2012-07-17 US disclosed
US-20120004411-A9 CHIRAL PHOSPHORUS COMPOUND JOHNSON MATTHEY PLC (GB) 2012-01-05 US disclosed
US-20100240898-A1 CHIRAL PHOSPHORUS COMPOUND JOHNSON MATTHEY PLC (GB) 2010-09-23 US disclosed
EP-2076524-A1 CHIRAL PHOSPHORUS COMPOUND Johnson Matthey Public Limited Company (GB) 2009-07-08 EP disclosed
WO-2008041029-A1 CHIRAL PHOSPHORUS COMPOUND JOHNSON MATTHEY PLC (GB) 2008-04-10 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 (4 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-20120264940-A1 CHIRAL PHOSPHORUS COMPOUND PIK3CA, RECQL, P2RY1 CYP1A2 915/4885CYP2D6 2081/4885CYP2C9 1355/4885
US-20120004411-A9 CHIRAL PHOSPHORUS COMPOUND PIK3CA, RECQL, P2RY1 CYP1A2 915/4885CYP2D6 2081/4885CYP2C9 1355/4885
US-20100240898-A1 CHIRAL PHOSPHORUS COMPOUND PIK3CA, RECQL, P2RY1 CYP1A2 915/4885CYP2D6 2081/4885CYP2C9 1355/4885
US-20130150583-A1 CHIRAL PHOSPHORUS COMPOUND ALPP, PTH1R, CALCR CYP1A2 2271/4885CYP2D6 3285/4885CYP2C9 2011/4885

“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.