SCHEMBL24673443

SCHEMBL24673443

CC(C)c1cc(Cl)cc(C(C)CCC(C)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.35
S1PR1 P21453 1/20 0.34
KCNH2 Q12809 3/20 0.32
TMEM97 Q5BJF2 3/20 0.32
P2RX3 P56373 1/20 0.32
RAPGEF4 Q8WZA2 1/20 0.32
PDE2A O00408 1/20 0.32
CETP P11597 1/20 0.32
GRN P28799 1/20 0.31
SORT1 Q99523 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
IDO1 P14902 1/20 0.30
TDO2 P48775 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
AHR P35869 1/20 0.30
P2RX1 P51575 1/20 0.30

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
SCHEMBL9967739 0.84 RAPGEF4 (0.41) TACR1S1PR1P2RX3RAPGEF4PDE2A
SCHEMBL10629252 0.78 TACR1 (0.39) TACR1S1PR1PDE2AIDO1TDO2
SCHEMBL437277 0.78 TACR1 (0.42) TACR1S1PR1RAPGEF4PDE2AIDO1
SCHEMBL16770635 0.78 RAPGEF4 (0.37) TACR1S1PR1RAPGEF4PDE2AGRN
SCHEMBL23627166 0.78 RAPGEF4 (0.37) TACR1S1PR1RAPGEF4PDE2AGRN
SCHEMBL16516214 0.76 PNMT (0.41) TACR1S1PR1IDO1TDO2
SCHEMBL24394377 0.75 TACR1 (0.40) TACR1S1PR1PDE2AIDO1TDO2
SCHEMBL19454917 0.73 DPP4 (0.40) TACR1S1PR1IDO1TDO2
SCHEMBL11574451 0.72 GABRA1 (0.46) IDO1TDO2CNR1CNR2
SCHEMBL19321650 0.72 GABRA1 (0.33) RAPGEF4PDE2AGRNSORT1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220267300-A1 SULFONAMIDE DERIVATIVES AND USES THEREOF NodThera Limited (GB) 2022-08-25 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-20220267300-A1 SULFONAMIDE DERIVATIVES AND USES THEREOF IL1B, IL1A, CASP1 TACR1 3892/4885S1PR1 291/4885KCNH2 4056/4885

“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.