SCHEMBL3686387

SCHEMBL3686387

O=S(=O)(Nc1ccc(Nc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.84
MEN1 O00255 6/20 0.84
PKM P14618 2/20 0.84
ALDH1A1 P00352 1/20 0.84
KEAP1 Q14145 2/20 0.83
IL1RN P18510 1/20 0.83
ERAP1 Q9NZ08 1/20 0.83
GAA P10253 3/20 0.77
GFER P55789 1/20 0.68
CA12 O43570 2/20 0.67
CA1 P00915 2/20 0.67
CA2 P00918 2/20 0.67
CA9 Q16790 2/20 0.67
MAPT P10636 2/20 0.65
HPGD P15428 2/20 0.65
PGR P06401 1/20 0.65
LMNA P02545 2/20 0.61
NAT1 P18440 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.59

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
SCHEMBL9001182 0.91 KMT2A (1.00) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL25031372 0.91 KEAP1 (1.00) KMT2AMEN1PKMALDH1A1KEAP1
Phenyl(Phenylsulfonyl)Amine SCHEMBL114765 0.91 KEAP1 (1.00) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL810795 0.91 KMT2A (0.91) KMT2AMEN1PKMALDH1A1KEAP1
Phenyl(Phenylsulfonyl)Amine SCHEMBL27503772 0.89 KEAP1 (0.95) KMT2AMEN1PKMALDH1A1KEAP1
Phenyl(Phenylsulfonyl)Amine SCHEMBL11513007 0.89 KEAP1 (0.95) KMT2AMEN1PKMALDH1A1KEAP1
Phenyl(Phenylsulfonyl)Amine SCHEMBL6399560 0.89 KEAP1 (0.95) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL9479782 0.89 MEN1 (0.67) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL92717 0.87 KMT2A (1.00) KMT2AMEN1PKMALDH1A1KEAP1
SCHEMBL1952693 0.87 KMT2A (1.00) KMT2AMEN1PKMALDH1A1KEAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8410150-B2 Inhibitors of carnitine palmitoyltransferase and treating cancer UNIVERSITY HEALTH NETWORK (CA) 2013-04-02 US disclosed
US-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK 2010-04-29 US disclosed
WO-2008109991-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER UNIVERSITY HEALTH NETWORK (CA) 2008-09-18 WO 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-20100105900-A1 INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER CPT1A, CPT1B, CPT2 KMT2A 662/4885MEN1 3665/4885PKM 1133/4885

“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.