SCHEMBL10064231

SCHEMBL10064231

Cc1ccc(C2CC2C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)OCCO4)CC2)cc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PKM P14618 12/20 0.65
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
LMNA P02545 5/20 0.64
ALDH1A1 P00352 3/20 0.61
TSHR P16473 2/20 0.61
NPSR1 Q6W5P4 1/20 0.61
PKLR P30613 3/20 0.56
RAB9A P51151 2/20 0.56
NPC1 O15118 1/20 0.56
HTT P42858 3/20 0.54
USP2 O75604 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 2/20 0.53
CREBBP Q92793 1/20 0.53
GAA P10253 3/20 0.53

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
SCHEMBL18286663 0.87 CNR1 (0.67) PKMLMNA
SCHEMBL10064229 0.82 ALDH1A1 (0.60) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL13668458 0.81 F13A1 (0.61) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL10064230 0.78 CNR1 (0.68) ALDH1A1
SCHEMBL1722758 0.75 PKM (1.00) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL10064238 0.75 PKM (0.66) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL14297903 0.72 CNR1 (0.80)
SCHEMBL1711139 0.72 PKM (0.72) PKMMEN1KMT2ALMNAALDH1A1
SCHEMBL19976588 0.71 PKM (0.69) PKMMEN1KMT2ALMNAPKLR
SCHEMBL1722457 0.71 PKM (0.65) PKMMEN1KMT2ALMNAPKLR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9115086-B2 Therapeutic compositions and related methods of use AGIOS PHARMACEUTICALS, INC. (US) 2015-08-25 US disclosed
US-20120165324-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE AGIOS PHARMACEUTICALS, INC. 2012-06-28 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-20120165324-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE PDK2, PDK1, PDK3 PKM 10/4885MEN1 3936/4885KMT2A 880/4885

“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.