SCHEMBL4837807

SCHEMBL4837807

COc1cccc(C(=O)Nc2ccc(C(=O)C=C3NC(C)(C)Cc4ccc(OC)cc43)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.51
NPC1 O15118 8/20 0.51
RAB9A P51151 8/20 0.51
MEN1 O00255 7/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
ALDH1A1 P00352 4/20 0.51
TP53 P04637 3/20 0.51
PKM P14618 2/20 0.51
HPGD P15428 1/20 0.51
MAPK1 P28482 1/20 0.51
KDM4E B2RXH2 1/20 0.49
TSHR P16473 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
AR P10275 1/20 0.48
MAPT P10636 3/20 0.47
LMNA P02545 2/20 0.47
QSOX1 O00391 1/20 0.46
L3MBTL1 Q9Y468 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
SCHEMBL4837792 1.00 KMT2A (0.51) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4841961 0.94 RAB9A (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4841947 0.94 RAB9A (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4843009 0.94 KCNK3 (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4843022 0.94 KCNK3 (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4847130 0.94 NPC1 (0.46) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4847114 0.94 NPC1 (0.46) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4840832 0.94 NPC1 (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4840822 0.94 NPC1 (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2
SCHEMBL4835417 0.93 RAB9A (0.49) KMT2ANPC1RAB9AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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 (1 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 KMT2A 4642/4885NPC1 985/4885RAB9A 2220/4885

“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.