SCHEMBL4950554

SCHEMBL4950554

Cc1nc(C(N)=O)c(-c2csc(NC(=O)[CH]CCc3ccccc3)n2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
NPSR1 Q6W5P4 3/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 5/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
TRPV4 Q9HBA0 1/20 0.43
GAA P10253 2/20 0.41
ATP4A P20648 5/20 0.41
ATP4B P51164 5/20 0.41
GSTO1 P78417 1/20 0.41
ELOVL1 Q9BW60 1/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 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
SCHEMBL5184585 0.79 GSTO1 (0.64) MAPTLMNAHTTSMN1; SMN2KDM4E
SCHEMBL16434204 0.72 MAPT (0.70) MAPTNPSR1LMNAHTTSMN1; SMN2
SCHEMBL4951232 0.72 ATAD2 (0.49) MAPTLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL5183397 0.71 GSTO1 (0.56) MAPTLMNAHTTSMN1; SMN2KDM4E
SCHEMBL4950561 0.71 MAPT (0.64) MAPTNPSR1LMNAHTTSMN1; SMN2
SCHEMBL4949867 0.69 GSTO1 (0.49) MAPTNPSR1LMNAHTTSMN1; SMN2
SCHEMBL4952246 0.68 ACHE (0.41) MAPTSMN1; SMN2KDM4EALDH1A1HPGD
SCHEMBL16440376 0.67 MAPT (0.59) MAPTNPSR1LMNAHTTSMN1; SMN2
SCHEMBL4949852 0.66 RAB9A (0.44) LMNASMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL16440427 0.66 MAPT (0.89) MAPTNPSR1LMNAHTTSMN1; SMN2

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-20080076741-A1 ENHANCEMENT OF TIGECYCLINE POTENCY USING EFFLUX PUMP INHIBITORS REMPEX PHARMACEUTICALS, INC. 2008-03-27 US disclosed
US-20060003944-A1 Bacterial efflux pump inhibitors and methods of treating bacterial infections REMPEX PHARMACEUTICALS, INC. 2006-01-05 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-20080076741-A1 ENHANCEMENT OF TIGECYCLINE POTENCY USING EFFLUX PUMP INHIBITORS ABCB1, ABCB11, SLC47A2 MAPT 4181/4885NPSR1 4395/4885LMNA 2815/4885
US-20060003944-A1 Bacterial efflux pump inhibitors and methods of treating bacterial infections ABCB11, ABCB1, ABCC1 MAPT 4102/4885NPSR1 4172/4885LMNA 3982/4885

“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.