SCHEMBL9515033

SCHEMBL9515033

CCCCc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
HPGD P15428 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PARP1 P09874 1/20 0.50
MAPK13 O15264 1/20 0.49
GCGR P47871 1/20 0.49
MAPK12 P53778 1/20 0.49
MAPK11 Q15759 1/20 0.49
MAPK14 Q16539 1/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
GPR84 Q9NQS5 1/20 0.45

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
SCHEMBL2050519 0.95 KDM4E (0.51) KDM4EHPGDSMN1; SMN2PARP1MAPK13
SCHEMBL14002072 0.94 KDM4E (0.50) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL8104088 0.94 KDM4E (0.50) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL10441820 0.94 KDM4E (0.50) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL9518314 0.90 ADORA3 (0.56) KDM4EHPGDSMN1; SMN2MAPK13GCGR
Ammonia Solution, Strong SCHEMBL27564581 0.89 ADORA3 (0.55) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL7272062 0.83 KDM4E (0.49) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL5378775 0.83 KDM4E (0.59) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL8127871 0.83 MAPK14 (0.48) KDM4EHPGDSMN1; SMN2MAPK13GCGR
SCHEMBL5675655 0.82 MAPK14 (0.44) KDM4EHPGDSMN1; SMN2PARP1MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365907-B1 Process for the preparation of p-nitrophenyl imidazoles BASF AG (DE) 1993-12-22 EP disclosed
US-5008398-A Preparation of p-nitrophenyl-imidazoles BASF AKTIENGESELLSCHAFT (DE) 1991-04-16 US disclosed
EP-0365907-A1 Process for the preparation of p-nitrophenyl imidazoles BASF Aktiengesellschaft (DE) 1990-05-02 EP disclosed
EP-0206030-A2 Photocurable composition SEKISUI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-12-30 EP disclosed