SCHEMBL4339555

SCHEMBL4339555

NC(=O)c1cnc2c(cnn2Cc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.47
▸ RECQL P46063 1/20 0.46
▸ HDAC8 Q9BY41 2/20 0.45
▸ ALDH1A1 P00352 3/20 0.44
▸ MAPT P10636 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ PTGS1 P23219 1/20 0.42
▸ OPRM1 P35372 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ NAMPT P43490 1/20 0.40

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
SCHEMBL30340510 0.79 GLO1 (0.57) ALDH1A1
SCHEMBL31632888 0.78 KDM4C (0.47) ALDH1A1KDM4E
SCHEMBL4789449 0.75 PDE1B (0.46) LMNAALDH1A1MAPTKDM4E
SCHEMBL29730634 0.74 ALDH1A1 (0.48) LMNARECQLALDH1A1MAPT
SCHEMBL17193676 0.74 ALDH1A1 (0.48) LMNARECQLALDH1A1MAPT
SCHEMBL23035775 0.74 — —
SCHEMBL29685884 0.73 RECQL (0.43) LMNARECQLALDH1A1KDM4EPTGS1
SCHEMBL14000509 0.71 RECQL (0.65) RECQLALDH1A1TSHRNAMPT
SCHEMBL25412409 0.71 RECQL (0.60) RECQLALDH1A1KDM4EPTGS1
SCHEMBL30614221 0.71 RECQL (0.60) RECQLALDH1A1KDM4EPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539753-B1 PYRAZOLO(3,4-B)PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2009-09-09 — — EP disclosed
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