SCHEMBL3201214

SCHEMBL3201214

CCc1cccc(N2C(=O)[C@@H]3[C@@H]4CC[C@@H]([C@@H]5C[C@@H]54)[C@@H]3C2=O)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.54
▸ ATM Q13315 2/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ ALOX5 P09917 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ LMNA P02545 1/20 0.40

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
SCHEMBL3201222 1.00 MGLL (0.54) MGLLATMKMT2ASMN1; SMN2MEN1
SCHEMBL3201219 1.00 MGLL (0.54) MGLLATMKMT2ASMN1; SMN2MEN1
SCHEMBL3180182 0.86 KMT2A (0.43) ATMKMT2AMEN1ALOX5L3MBTL1
SCHEMBL3180167 0.86 KMT2A (0.43) ATMKMT2AMEN1ALOX5L3MBTL1
SCHEMBL3180176 0.86 KMT2A (0.43) ATMKMT2AMEN1ALOX5L3MBTL1
SCHEMBL3190648 0.82 SMN1; SMN2 (0.59) MGLLKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL3190638 0.82 SMN1; SMN2 (0.59) MGLLKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL3190236 0.82 SMN1; SMN2 (0.59) MGLLKMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL3188968 0.80 ALDH1A1 (0.59) MGLLATMKMT2ASMN1; SMN2MEN1
SCHEMBL3188953 0.80 ALDH1A1 (0.59) MGLLATMKMT2ASMN1; SMN2MEN1

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 MGLL 4489/4885ATM 1135/4885KMT2A 1756/4885
US-20060111424-A1 Fused cyclic succinimide compounds and analogs thereof, modulators of nuclear hormone receptor function NCOA1, ESRRA, NR5A1 MGLL 4489/4885ATM 1135/4885KMT2A 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.

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