SCHEMBL4992841

SCHEMBL4992841

CC(C)c1ccc(Cn2cccc(C(=O)O)c2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.56
BRD2 P25440 1/20 0.56
BRD3 Q15059 1/20 0.56
BRDT Q58F21 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 1/20 0.51
RAB9A P51151 1/20 0.51
KDM4E B2RXH2 5/20 0.49
ALDH1A1 P00352 3/20 0.49
VEGFA P15692 1/20 0.48
EGLN1 Q9GZT9 1/20 0.48
LMNA P02545 1/20 0.46
CNR1 P21554 4/20 0.46
CNR2 P34972 4/20 0.46
HTT P42858 1/20 0.46
TP53 P04637 2/20 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
SCHEMBL6524399 0.85 VEGFA (0.65) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL4997127 0.85 BRD4 (0.52) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL4995076 0.85 KDM4E (0.56) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL19787909 0.84 MAPT (0.60) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL1137531 0.84 BRD4 (0.70) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL2621620 0.82 CNR1 (0.60) BRD4BRD2BRD3BRDTSMN1; SMN2
Hydrochloric Acid SCHEMBL11454825 0.82 BRD4 (0.68) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL4996274 0.81 PTGER3 (0.43) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL4437360 0.81 BRD4 (0.56) BRD4BRD2BRD3BRDTSMN1; SMN2
SCHEMBL4992892 0.81 BRD4 (0.68) BRD4BRD2BRD3BRDTSMN1; 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
CN-101611008-A C3A receptor modulators and methods of use thereof ENCYSIVE PHARMACEUTICALS INC (US) 2009-12-23 CN disclosed
US-20080188528-A1 Modulators of C3a receptor and methods of use thereof ENCYSIVE PHARMACEUTICALS, INC. 2008-08-07 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-20080188528-A1 Modulators of C3a receptor and methods of use thereof C3AR1, C5, C5AR1 BRD4 2776/4885BRD2 4008/4885BRD3 3120/4885

“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.