SCHEMBL3192164

SCHEMBL3192164

O=C1C2C3C=CC(CC3)C2C(=O)N1c1ccc(N2CCOCC2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.48
RAD51 Q06609 3/20 0.47
ATM Q13315 1/20 0.47
POLB P06746 1/20 0.47
RAD1 O60671 1/20 0.46
BCL2A1 Q16548 1/20 0.46
ALDH3A1 P30838 1/20 0.46
ALDH1A3 P47895 1/20 0.46

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
SCHEMBL3192147 1.00 ALDH1A1 (0.51) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL3198897 0.93 MEN1 (0.60) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL4591467 0.93 MEN1 (0.60) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL3198907 0.93 MEN1 (0.60) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL3188185 0.85 MAPT (0.49) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL3188169 0.85 MAPT (0.49) ALDH1A1KMT2AMEN1GAAMAPT
SCHEMBL3186852 0.83 KMT2A (0.58) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL3186839 0.83 KMT2A (0.58) ALDH1A1KMT2AMEN1GAASMN1; SMN2
SCHEMBL4591257 0.82 ALDH1A1 (0.58) ALDH1A1KMT2AGAAMAPTSMN1; SMN2
SCHEMBL3204323 0.80 KMT2A (0.64) ALDH1A1KMT2AMEN1L3MBTL1ATM

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 ALDH1A1 3191/4885KMT2A 1756/4885MEN1 1676/4885
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 ALDH1A1 3191/4885KMT2A 1756/4885MEN1 1676/4885

“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.