SCHEMBL14014183

SCHEMBL14014183

COc1ccc(-c2cc(C(=O)O)nc3cc(-c4ccccc4)nn23)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
ATM Q13315 1/20 0.63
RPA1 P27694 3/20 0.59
ALDH1A1 P00352 9/20 0.57
KDM4E B2RXH2 8/20 0.57
MAPT P10636 6/20 0.56
GAA P10253 4/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
MCL1 Q07820 2/20 0.55
LMNA P02545 3/20 0.53
GLA P06280 3/20 0.52
POLB P06746 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
HPGD P15428 3/20 0.51
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
STAT1 P42224 1/20 0.50
PKM P14618 1/20 0.49

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
SCHEMBL14014249 0.87 KDM4E (0.79) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL14014181 0.84 KDM4E (0.61) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL14014221 0.81 KDM4E (0.70) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL22491836 0.81 MCL1 (0.52) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL14014192 0.78 KDM4E (0.64) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL14014213 0.78 KDM4E (0.64) MEN1KMT2AATMALDH1A1KDM4E
SCHEMBL14014350 0.77 KDM4E (0.63) MEN1KMT2ARPA1ALDH1A1KDM4E
SCHEMBL12465733 0.77 MCL1 (0.51) MEN1KMT2AATMRPA1ALDH1A1
SCHEMBL14014274 0.77 KDM4E (0.70) MEN1KMT2ARPA1ALDH1A1KDM4E
SCHEMBL14014260 0.77 KDM4E (0.62) MEN1KMT2AATMRPA1ALDH1A1

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
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed