SCHEMBL3430801

SCHEMBL3430801

Cc1ccc(NC(=O)c2nn(Cc3ccc(S(C)(=O)=O)cc3)c3ccccc23)cc1C

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.54
IDH1 O75874 1/20 0.49
RAB9A P51151 2/20 0.48
KDM4E B2RXH2 2/20 0.48
NPC1 O15118 1/20 0.48
MCL1 Q07820 1/20 0.48
PTGER4 P35408 5/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
ROCK1 Q13464 1/20 0.46
ROCK2 O75116 2/20 0.44
CNR1 P21554 1/20 0.44
AURKA O14965 1/20 0.44
AURKB Q96GD4 1/20 0.44
POLB P06746 1/20 0.43
MAOB P27338 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.42

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
SCHEMBL3755332 0.91 KDM4E (0.54) IDH1KDM4EMCL1PTGER4KMT2A
SCHEMBL3411563 0.89 ELANE (0.51) MAPTIDH1KDM4EMCL1PTGER4
SCHEMBL3431404 0.89 IDH1 (0.49) MAPTIDH1RAB9AKDM4ENPC1
SCHEMBL3427738 0.89 MCL1 (0.59) IDH1RAB9AKDM4ENPC1MCL1
SCHEMBL3428395 0.88 PTGER4 (0.54) IDH1KDM4EMCL1PTGER4KMT2A
SCHEMBL3430198 0.87 KDM4E (0.51) IDH1KDM4EMCL1PTGER4KMT2A
SCHEMBL3428570 0.87 KDM4E (0.51) IDH1KDM4EMCL1PTGER4KMT2A
SCHEMBL3428006 0.87 PTGER4 (0.57) MAPTIDH1KDM4EMCL1PTGER4
SCHEMBL3429031 0.87 MEN1 (0.51) IDH1RAB9AKDM4ENPC1MCL1
SCHEMBL3428417 0.86 PTGER4 (0.57) MAPTIDH1KDM4EMCL1PTGER4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US claimed
EP-2257340-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BioMarin IGA Limited (BS) 2010-12-08 EP disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
WO-2009121623-A2 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2009-10-08 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-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY CPT1B, SMN1; SMN2, GYS1 MAPT 3715/4885IDH1 1584/4885RAB9A 2878/4885

“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.