SCHEMBL4863675

SCHEMBL4863675

CC[C@@H]1C(=O)N(C)c2cc(F)ccc2N1C(=O)c1cccc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HSD11B1 P28845 1/20 0.44
CBX7 O95931 1/20 0.44
CDYL2 Q8N8U2 1/20 0.44
CDYL Q9Y232 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
HPGD P15428 1/20 0.39
VNN1 O95497 1/20 0.39

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
SCHEMBL4870374 0.89 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4870429 0.87 ALDH1A1 (0.49) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4864215 0.86 KMT2A (0.40) KMT2AMEN1LMNA
SCHEMBL4864150 0.85 KMT2A (0.57) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4867889 0.84 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4866466 0.84 SMN1; SMN2 (0.43) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4864118 0.81 KMT2A (0.48) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4865526 0.81 KMT2A (0.40) KMT2AMEN1
SCHEMBL4490943 0.80 ALDH1A1 (0.46) ALDH1A1NPC1RAB9ASMN1; SMN2HSD11B1
SCHEMBL4869782 0.76 BRD4 (0.39) KMT2AMEN1

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-7351709-B2 Estrogen receptor ligands WYETH (US) 2008-04-01 US disclosed
US-20060019961-A1 Estrogen receptor ligands WYETH 2006-01-26 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-20060019961-A1 Estrogen receptor ligands GPER1, ESR2, ESR1 ALDH1A1 1051/4885NPC1 1178/4885RAB9A 3365/4885

“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.