SCHEMBL3767339

SCHEMBL3767339

Cc1ccc(C(=O)Nc2ccnn2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.51
NPC1 O15118 6/20 0.51
SMN1; SMN2 Q16637 6/20 0.50
TP53 P04637 1/20 0.50
HPGDS O60760 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NAMPT P43490 2/20 0.48
GAA P10253 1/20 0.47
HDAC1 Q13547 2/20 0.47
MAPK14 Q16539 3/20 0.47
LCK P06239 1/20 0.47
HDAC6 Q9UBN7 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.46
NFKB1 P19838 1/20 0.46

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
SCHEMBL13213725 0.86 POLB (0.50) RAB9ANPC1SMN1; SMN2TP53HPGDS
SCHEMBL396727 0.85 POLB (0.53) RAB9ANPC1HPGDSKMT2AGAA
SCHEMBL14699724 0.84 KMT2A (0.54) RAB9ANPC1SMN1; SMN2HPGDSKMT2A
SCHEMBL14938017 0.83 OXTR (0.57) SMN1; SMN2HPGDSKMT2A
SCHEMBL3892152 0.80 HPGDS (0.49) RAB9ANPC1SMN1; SMN2HPGDSKMT2A
SCHEMBL4035180 0.80 MAPK14 (0.56) SMN1; SMN2TP53HPGDSKMT2AALDH1A1
SCHEMBL3268236 0.79 KMT2A (0.57) RAB9ANPC1SMN1; SMN2HPGDSKMT2A
SCHEMBL6331796 0.79 HPGDS (0.46) RAB9ANPC1SMN1; SMN2TP53HPGDS
SCHEMBL15015974 0.78 GRM5 (0.62) RAB9ANPC1SMN1; SMN2KMT2AALDH1A1
SCHEMBL19520435 0.77 LMNA (0.56) RAB9ANPC1SMN1; SMN2TP53ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846944-B2 Pyrazolo-pyridinone compounds and methods of use thereof AMGEN INC. (US) 2010-12-07 US disclosed
US-20090012299-A1 Pyrazolo-pyridinone compounds and methods of use thereof AMGEN INC. (US) 2009-01-08 US disclosed
US-20080119468-A1 Phthalazine, aza-and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2008-05-22 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 (2 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-20080119468-A1 Phthalazine, aza-and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 RAB9A 3386/4885NPC1 4272/4885SMN1; SMN2 4540/4885
US-20090012299-A1 Pyrazolo-pyridinone compounds and methods of use thereof MAPK1, MAP3K1, MAP4K2 RAB9A 1525/4885NPC1 3778/4885SMN1; SMN2 4206/4885

“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.