SCHEMBL4834808

SCHEMBL4834808

COc1ccc2c(c1)C(=CC(=O)c1cccc(NC(=O)CCCl)c1)NC(C)(C)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KMT2A Q03164 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
HTT P42858 2/20 0.41
MTNR1B P49286 2/20 0.40
CASP3 P42574 1/20 0.39
ALDH1A1 P00352 3/20 0.39
FGFR1 P11362 1/20 0.39
FGFR2 P21802 1/20 0.39
FGFR4 P22455 1/20 0.39
FGFR3 P22607 1/20 0.39
KDM4E B2RXH2 1/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL4834795 1.00 TP53 (0.42) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4840010 0.95 LMNA (0.46) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4839994 0.95 LMNA (0.46) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4835757 0.94 LMNA (0.46) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4835734 0.94 LMNA (0.46) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4838794 0.94 MTNR1B (0.47) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4838804 0.94 MTNR1B (0.47) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4844392 0.91 ALDH1A1 (0.48) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4844404 0.91 ALDH1A1 (0.48) TP53RXFP1KMT2ASMN1; SMN2LMNA
SCHEMBL4835408 0.91 LMNA (0.40) TP53KMT2ALMNAMEN1HTT

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 TP53 2237/4885RXFP1 645/4885KMT2A 4642/4885

“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.