SCHEMBL3187065

SCHEMBL3187065

Cc1ccc(COc2ccccc2N2C(=O)C3C4C=CC(C4)C3C2=O)cc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ MAPT P10636 1/20 0.58
▸ GAA P10253 3/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ HTT P42858 1/20 0.53
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ TSHR P16473 2/20 0.47
▸ ESR2 Q92731 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL3190327 0.90 MAPT (0.67) KMT2AMEN1MAPTGAANPC1
SCHEMBL3196858 0.88 MEN1 (0.60) KMT2AMEN1MAPTGAANPC1
SCHEMBL3190054 0.86 MEN1 (0.58) KMT2AMEN1MAPTGAANPC1
SCHEMBL3190424 0.84 MEN1 (0.55) KMT2AMEN1MAPTGAANPC1
SCHEMBL3186757 0.79 MEN1 (0.60) KMT2AMEN1MAPTGAANPC1
SCHEMBL3199914 0.78 SMN1; SMN2 (0.53) KMT2AHTTSMN1; SMN2ALDH1A1TSHR
SCHEMBL5512699 0.78 MEN1 (1.00) KMT2AMEN1MAPTGAANPC1
SCHEMBL3187762 0.78 TSHR (0.51) KMT2AMEN1TSHR
SCHEMBL19320589 0.74 SMN1; SMN2 (0.50) KMT2AMEN1NPC1RAB9AHTT
SCHEMBL5515994 0.73 MEN1 (0.66) KMT2AMEN1MAPTSMN1; SMN2TSHR

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-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
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 (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 KMT2A 1756/4885MEN1 1676/4885MAPT 4124/4885

“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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