SCHEMBL3189028

SCHEMBL3189028

O=C1CC2CCC1C1C(=O)N(c3cc(Cl)cc(Cl)c3)C(=O)C21

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TSHR P16473 5/20 0.42
ALDH1A1 P00352 5/20 0.42
ALOX15 P16050 4/20 0.42
HSD17B10 Q99714 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
ALOX12 P18054 1/20 0.35
USP2 O75604 1/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.33

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
SCHEMBL3189002 1.00 MEN1 (0.42) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3189013 1.00 MEN1 (0.42) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL6746077 0.88 MEN1 (0.41) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3189746 0.88 MEN1 (0.41) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL6746083 0.88 MEN1 (0.41) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3186296 0.86 ALDH1A1 (0.60) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3186287 0.86 ALDH1A1 (0.60) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3186283 0.86 ALDH1A1 (0.60) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL4591981 0.84 MEN1 (0.41) MEN1KMT2ATSHRALDH1A1ALOX15
SCHEMBL3197995 0.84 MEN1 (0.41) MEN1KMT2ATSHRALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function SALVATI MARK E 2006-05-25 US claimed
US-20040087548-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMPANY 2004-05-06 US claimed
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 disclosed
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function SALVATI MARK E 2006-05-25 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 (2 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-20040087548-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 MEN1 1676/4885KMT2A 1756/4885TSHR 133/4885
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 MEN1 1676/4885KMT2A 1756/4885TSHR 133/4885

“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.