SCHEMBL3200103

SCHEMBL3200103

O=C1C[C@@H]2CC[C@H]1[C@@H]1C(=O)N(c3ccc(Br)cc3)C(=O)[C@H]21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 4/20 0.40
ALOX15 P16050 3/20 0.40
HSD17B10 Q99714 1/20 0.40
ALDH1A1 P00352 5/20 0.40
ATM Q13315 2/20 0.39
GAA P10253 1/20 0.39
HSP90AA1 P07900 1/20 0.39
FAAH O00519 1/20 0.39
MGLL Q99685 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PLEC Q15149 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 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
SCHEMBL3200111 1.00 MEN1 (0.49) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL3200093 1.00 MEN1 (0.49) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL3194270 0.85 MEN1 (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL3194277 0.85 MEN1 (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL4591981 0.85 MEN1 (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL3194285 0.85 MEN1 (0.41) MEN1KMT2ASMN1; SMN2L3MBTL1LMNA
SCHEMBL5923081 0.85 KMT2A (0.49) MEN1KMT2ASMN1; SMN2LMNATSHR
SCHEMBL5923075 0.85 KMT2A (0.49) MEN1KMT2ASMN1; SMN2LMNATSHR
SCHEMBL3189270 0.85 KMT2A (0.49) MEN1KMT2ASMN1; SMN2LMNATSHR
SCHEMBL4592060 0.83 MEN1 (0.46) MEN1KMT2ASMN1; SMN2LMNATSHR

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 1756/4885SMN1; SMN2 3782/4885
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 MEN1 1676/4885KMT2A 1756/4885SMN1; SMN2 3782/4885

“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.