SCHEMBL3194451

SCHEMBL3194451

O=C1C2C3CCC(C3)C2C(=O)N1c1ccc(F)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.54
LMNA P02545 4/20 0.54
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
HPGD P15428 2/20 0.49
POLB P06746 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
GAA P10253 2/20 0.48
MAPT P10636 2/20 0.46
ADCY2 Q08462 1/20 0.46
ADRA2A P08913 1/20 0.46
ALDH1A1 P00352 3/20 0.46
HSP90AA1 P07900 1/20 0.46
KDM4E B2RXH2 1/20 0.44
USP2 O75604 1/20 0.44
ALOX15 P16050 1/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL3194443 1.00 SMN1; SMN2 (0.54) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3187274 0.84 KMT2A (0.47) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3187261 0.84 KMT2A (0.47) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3187266 0.84 KMT2A (0.47) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3189056 0.84 ALDH1A1 (0.43) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3189077 0.84 ALDH1A1 (0.43) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3189070 0.84 ALDH1A1 (0.43) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL3186510 0.82 TSHR (0.58) SMN1; SMN2KMT2AMEN1HPGDGAA
SCHEMBL4591367 0.82 LMNA (0.52) SMN1; SMN2LMNAKMT2AMEN1HPGD
SCHEMBL6746126 0.82 LMNA (0.52) SMN1; SMN2LMNAKMT2AMEN1HPGD

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-7655688-B2 Treating nuclear hormone receptor-associated conditions such as cancer and immune disorders; (3a alpha ,4 alpha ,7 alpha ,7a alpha )-2-(3-Chloro-4-hydroxyphenyl)hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione BRISTOL-MYERS SQUIBB COMPANY (US) 2010-02-02 US claimed
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function SALVATI MARK E 2006-05-25 US claimed

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-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 SMN1; SMN2 3782/4885LMNA 3452/4885KMT2A 1756/4885

“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.