SCHEMBL19203745

SCHEMBL19203745

CCCC(C)(C)c1ncccc1C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 5/20 0.43
EPHX2 P34913 1/20 0.39
HSD11B1 P28845 3/20 0.35
GAA P10253 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
NFE2L2 Q16236 2/20 0.34
HTR1A P08908 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
GRM4 Q14833 2/20 0.33
CTNNB1 P35222 1/20 0.33
WNT3A P56704 1/20 0.33
CXCR4 P61073 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
TRPV1 Q8NER1 1/20 0.33

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
SCHEMBL23419080 0.90 SSTR4 (0.41) SSTR4EPHX2HSD11B1GAASLC22A12
SCHEMBL20193838 0.86 P2RY1 (0.34) SSTR4GRM4CXCR4
SCHEMBL20031355 0.86 SSTR4 (0.42) SSTR4EPHX2HSD11B1GAASLC22A12
SCHEMBL23419232 0.84 SSTR4 (0.41) SSTR4EPHX2HSD11B1GAASLC22A12
SCHEMBL18467354 0.79 TLR8 (0.32) SSTR4GRM4
SCHEMBL22140357 0.79 GRM4 (0.32) NFE2L2GRM4TRPV1
SCHEMBL29502462 0.79 SSTR4 (0.47) SSTR4EPHX2GAASLC22A12NFE2L2
SCHEMBL11955143 0.78 SSTR4 (0.46) SSTR4EPHX2HSD11B1GAASLC22A12
SCHEMBL22140280 0.77 SSTR4 (0.40) SSTR4
SCHEMBL23419175 0.77 SSTR4 (0.39) SSTR4EPHX2HSD11B1CXCR4

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-20230381144-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN SYNVENTA LLC (US) 2023-11-30 US disclosed
US-20210155597-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN SYNVENTA LLC 2021-05-27 US disclosed
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 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 (3 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-20230381144-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN TRPV1, OPRL1, ADRA2C SSTR4 2201/4885EPHX2 781/4885HSD11B1 2428/4885
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA SSTR4 1852/4885EPHX2 1070/4885HSD11B1 1304/4885
US-20210155597-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PAIN TRPV1, OPRL1, OPRK1 SSTR4 1126/4885EPHX2 948/4885HSD11B1 1850/4885

“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.