SCHEMBL6488926

SCHEMBL6488926

O=C(CNO)c1cccc(Cl)c1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.62
FEN1 P39748 1/20 0.62
PARP1 P09874 1/20 0.53
FLT1 P17948 1/20 0.47
FLT4 P35916 1/20 0.47
KDR P35968 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
P2RX7 Q99572 1/20 0.46
KCNMA1 Q12791 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PKM P14618 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
SCHEMBL18410881 0.85 ERCC5 (0.62) ERCC5FEN1PARP1FLT1FLT4
SCHEMBL11791699 0.84 ERCC5 (0.76) ERCC5FEN1PARP1MEN1KMT2A
SCHEMBL29962144 0.84 ERCC5 (0.76) ERCC5FEN1PARP1MEN1KMT2A
SCHEMBL10481543 0.84 ERCC5 (0.60) ERCC5FEN1PARP1ALDH1A1MEN1
SCHEMBL11761251 0.82 ERCC5 (0.58) ERCC5FEN1PARP1ALDH1A1MEN1
SCHEMBL7438839 0.81 ERCC5 (0.57) ERCC5FEN1PARP1ALDH1A1MEN1
SCHEMBL19707256 0.80 ERCC5 (0.55) ERCC5FEN1PARP1FLT1FLT4
SCHEMBL8858796 0.80 ERCC5 (0.59) ERCC5FEN1ALDH1A1MEN1KMT2A
SCHEMBL7690326 0.80 ERCC5 (0.64) ERCC5FEN1PARP1ALDH1A1MEN1
SCHEMBL1421231 0.79 ERCC5 (0.74) ERCC5FEN1PARP1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6919359-B2 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PFIZER INC (US) 2005-07-19 US disclosed
US-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-11-06 US 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-20030207913-A1 Azabicyclic-substituted-heteroaryl compounds for the treatment of disease MALT1, WFS1, NR5A1 ERCC5 460/4885FEN1 784/4885PARP1 936/4885

“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.