SCHEMBL29288018

SCHEMBL29288018

O=CNc1cnc(-c2cccnc2)n(-c2ccccc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.46
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
G6PD P11413 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.41
POLB P06746 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MDM2 Q00987 1/20 0.40
KDM4E B2RXH2 1/20 0.40
DAPK3 O43293 1/20 0.39

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
SCHEMBL9894437 0.77 MAPT (0.50) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL30672492 0.75 MAPT (0.48) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL29288019 0.75 MAPT (0.48) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL25663120 0.71 MAPT (0.80) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL9893973 0.71 NPC1 (0.59) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL6259007 0.68 ELANE (0.47) ALDH1A1L3MBTL1KDM4E
SCHEMBL15315963 0.68 KDM4E (0.46) MAPTALDH1A1MEN1KMT2AG6PD
SCHEMBL514425 0.65 AVPR1A (0.68) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL19244954 0.65 CYP2A6 (0.49) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL10432252 0.64 ALDH1A1 (0.55) MAPTALDH1A1MEN1KMT2AL3MBTL1

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
CN-109348715-A pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2019-02-15 CN claimed