SCHEMBL17347485

SCHEMBL17347485

COCCNC(=O)c1cc(NS(=O)(=O)c2ccccc2F)ccn1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
POLB P06746 3/20 0.47
GLA P06280 1/20 0.46
HPGD P15428 2/20 0.44
MAPT P10636 1/20 0.44
KAT6A Q92794 3/20 0.43
ANO1 Q5XXA6 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PIK3C3 Q8NEB9 1/20 0.42
PKM P14618 2/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
SGK1 O00141 1/20 0.41
KIT P10721 1/20 0.41
BRAF P15056 1/20 0.41

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
SCHEMBL17331347 0.85 POLB (0.58) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL17347484 0.82 ALDH1A1 (0.63) ALDH1A1MEN1KMT2ASMN1; SMN2GLA
SCHEMBL17347430 0.82 FABP4 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL8869236 0.80 POLB (0.55) ALDH1A1SMN1; SMN2POLBKDM4EPKM
SCHEMBL19102218 0.79 POLB (0.59) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL8869198 0.75 POLB (0.47) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL17331332 0.73 POLB (0.60) ALDH1A1MEN1KMT2APOLBMAPT
SCHEMBL17331327 0.72 POLB (0.58) ALDH1A1KMT2ASMN1; SMN2POLBTSHR
SCHEMBL17347543 0.70 FABP4 (0.49) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
Lufironil SCHEMBL344625 0.70 HPGD (0.56) ALDH1A1MEN1KMT2AHPGD

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-9701627-B2 LRRK2 GTP binding inhibitors for treatment of Parkinson's disease and neuroinflammatory disorders UNIVERSITY OF MARYLAND, BALTIMORE (US) 2017-07-11 US disclosed
US-20150361038-A1 LRRK2 GTP BINDING INHIBITORS FOR TREATMENT OF PARKINSON'S DISEASE AND NEUROINFLAMMATORY DISORDERS UNIVERSITY OF MARYLAND, BALTIMORE 2015-12-17 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-20150361038-A1 LRRK2 GTP BINDING INHIBITORS FOR TREATMENT OF PARKINSON'S DISEASE AND NEUROINFLAMMATORY DISORDERS LRRK2, PARK7, SNCA ALDH1A1 4655/4885MEN1 4396/4885KMT2A 2480/4885

“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.