SCHEMBL17347484

SCHEMBL17347484

COCCNC(=O)c1cccc(NS(=O)(=O)c2ccccc2F)c1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.63
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
GLA P06280 1/20 0.63
MAPT P10636 2/20 0.54
HPGD P15428 2/20 0.52
PKM P14618 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
KAT6A Q92794 7/20 0.49
MAPK1 P28482 1/20 0.49
LMNA P02545 2/20 0.47

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
SCHEMBL17347430 0.84 FABP4 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2GLA
SCHEMBL17347402 0.84 KDM1A (0.61) MEN1KMT2AMAPTHPGDLMNA
SCHEMBL17347485 0.82 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2GLA
SCHEMBL27856511 0.81 ALDH1A1 (0.59) ALDH1A1MEN1KMT2ASMN1; SMN2GLA
SCHEMBL27421449 0.80 MAPT (0.60) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL17331311 0.80 KDM1A (0.70) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL17331331 0.79 LMNA (0.60) MEN1KMT2ALMNA
SCHEMBL17343057 0.78 TSHR (0.62) ALDH1A1MEN1KMT2ASMN1; SMN2GLA
SCHEMBL17331308 0.76 KMT2A (0.50) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL2825815 0.76 SMN1; SMN2 (0.58) ALDH1A1MEN1KMT2ASMN1; SMN2GLA

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.