SCHEMBL6996833

SCHEMBL6996833

Cc1cc(=O)oc2c(CN3C(=O)c4ccccc4C3=O)c(O)ccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERAP1 Q9NZ08 4/20 0.63
KMT2A Q03164 2/20 0.63
HSD17B10 Q99714 4/20 0.61
CASP1 P29466 3/20 0.61
CASP7 P55210 3/20 0.61
RXFP1 Q9HBX9 1/20 0.58
ALDH1A1 P00352 7/20 0.57
KDM4E B2RXH2 5/20 0.57
GAA P10253 5/20 0.57
HPGD P15428 4/20 0.57
GLA P06280 2/20 0.57
TSHR P16473 1/20 0.57
CA9 Q16790 1/20 0.56
MAOB P27338 2/20 0.53
MCL1 Q07820 2/20 0.53
LMNA P02545 2/20 0.53
MGAM O43451 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL11310023 0.80 MAPT (0.42) ERAP1KMT2AHSD17B10CASP1CASP7
SCHEMBL6993185 0.79 KDM4E (0.52) KMT2AHSD17B10CASP1CASP7ALDH1A1
SCHEMBL7002316 0.78 KDM4E (0.58) KMT2AALDH1A1KDM4EGAAHPGD
SCHEMBL18155873 0.77 KDM4E (0.67) ERAP1KMT2AHSD17B10CASP1CASP7
SCHEMBL4958027 0.77 KCNA3 (0.46) KMT2AHSD17B10ALDH1A1KDM4EGAA
SCHEMBL11079352 0.75 GAA (0.63) ERAP1KMT2AHSD17B10CASP1CASP7
SCHEMBL6994888 0.74 SHBG (0.62) HSD17B10CASP1CASP7ALDH1A1KDM4E
SCHEMBL7001521 0.74 MAOA (0.63) ERAP1KMT2AHSD17B10CASP1CASP7
SCHEMBL8876199 0.74 KCNA3 (0.47) KMT2AHSD17B10RXFP1ALDH1A1KDM4E
SCHEMBL10404938 0.73 KCNA3 (0.52) KMT2AHSD17B10ALDH1A1KDM4EGAA

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 ERAP1 2643/4885KMT2A 2413/4885HSD17B10 2207/4885

“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.