SCHEMBL7142288

SCHEMBL7142288

C=CC(N)c1cc2ccccc2oc1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.51
POLB P06746 1/20 0.51
HPGD P15428 3/20 0.47
TYR P14679 1/20 0.47
DAO P14920 1/20 0.47
AKR1B1 P15121 1/20 0.47
CA12 O43570 3/20 0.46
CA9 Q16790 3/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 1/20 0.46
MAOB P27338 7/20 0.45
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 5/20 0.45
RAB9A P51151 3/20 0.45
NCOA1 Q15788 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
CA3 P07451 1/20 0.44
TSHR P16473 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44

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
SCHEMBL9233565 0.81 HPGD (0.47) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL7143389 0.81 HPGD (0.51) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL1264494 0.79 SMN1; SMN2 (0.56) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL7921349 0.79 HTT (0.54) KDM4ERAB9ANPC1CYP2A6GAA
SCHEMBL3264168 0.78 CYP2A6 (0.43) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL7140688 0.78 ALDH1A1 (0.47) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL15736793 0.76 SMN1; SMN2 (0.53) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL11881581 0.75 MAOB (0.55) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL1568299 0.75 HPGD (0.59) SMN1; SMN2POLBHPGDTYRDAO
SCHEMBL12456653 0.75 HPGD (0.55) SMN1; SMN2POLBHPGDTYRDAO

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
EP-1032265-B1 NEW PSORALENS FOR PATHOGEN INACTIVATION CERUS CORP (US) 2003-10-29 EP disclosed
US-20030082510-A1 Psoralens for pathogen inactivation CERUS CORPORATION (US) 2003-05-01 US disclosed
US-6455286-B1 MIXING PSORALEN COMPOUND OF DEFINED STRUCTURE WITH BIOLOGICAL COMPOSITION SUCH AS BLOOD OR PLATELETS, THEN PHOTOACTIVATING COMPOUND TO DEACTIVATE PATHOGEN CERUS CORPORATION 2002-09-24 US disclosed
EP-1032265-A4 NEW PSORALENS FOR PATHOGEN INACTIVATION CERUS CORP (US) 2001-05-30 EP disclosed
US-6133460-A HAVE PRIMARY AMINO SUBSTITUTIONS ON THE 3-, 4-, 5-, AND 8-POSITIONS OF THE PSORALEN WHICH PERMIT BINDING TO NUCLEIC ACID OF PATHOGENS; CONDITIONS THAT PHOTOACTIVATE THESE PSORALENS RESULT IN INACTIVATION OF PATHOGENS WHICH CONTAIN NUCLEIC ACID CERUS CORPORATION (US) 2000-10-17 US disclosed
EP-1032265-A1 NEW PSORALENS FOR PATHOGEN INACTIVATION Cerus Corporation (US) 2000-09-06 EP disclosed
WO-1999026476-A1 NEW PSORALENS FOR PATHOGEN INACTIVATION CERUS CORPORATION (US) 1999-06-03 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 (1 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-20030082510-A1 Psoralens for pathogen inactivation BPGM, XPA, RAD50 SMN1; SMN2 2763/4885POLB 39/4885HPGD 1063/4885

“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.