SCHEMBL12407095

SCHEMBL12407095

Cc1ccc(NS(=O)(=O)C2CC2)c(F)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MRGPRX1 Q96LB2 7/20 0.51
HRH1 P35367 1/20 0.51
KIT P10721 1/20 0.45
TLR4 O00206 1/20 0.44
TSPO P30536 1/20 0.41
BRAF P15056 1/20 0.39
KMT2A Q03164 1/20 0.38
ALOX5AP P20292 1/20 0.38
FEN1 P39748 1/20 0.38

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
SCHEMBL391647 0.85 MRGPRX1 (0.44) MRGPRX1HRH1KITTLR4TSPO
SCHEMBL12407120 0.83 FKBP1A (0.53) MRGPRX1HRH1KMT2A
SCHEMBL14830633 0.83 KIT (0.52) MRGPRX1HRH1KITTSPOKMT2A
SCHEMBL19050690 0.82 MRGPRX1 (0.41) MRGPRX1HRH1KITTLR4TSPO
SCHEMBL13855804 0.81
SCHEMBL19050669 0.80 MRGPRX1 (0.40) MRGPRX1HRH1TLR4BRAFKMT2A
SCHEMBL4134490 0.79 MAP2K1 (0.54) MRGPRX1HRH1KITBRAF
SCHEMBL19050673 0.79 MRGPRX1 (0.40) MRGPRX1HRH1TLR4BRAFKMT2A
SCHEMBL9284438 0.79 BRAF (0.48) MRGPRX1HRH1BRAF
SCHEMBL19050657 0.79 MEN1 (0.47) MRGPRX1HRH1TLR4BRAFKMT2A

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-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 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-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS MRGPRX1 1873/4885HRH1 2713/4885KIT 1858/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS MRGPRX1 1873/4885HRH1 2713/4885KIT 1858/4885

“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.