SCHEMBL19040340

SCHEMBL19040340

CCCOc1ncc(C)cc1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
RXRA P19793 1/20 0.33
BTK Q06187 1/20 0.33
NPBWR1 P48145 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MCHR1 Q99705 1/20 0.33
SLC13A5 Q86YT5 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
PDE1A P54750 1/20 0.30
PDE1B Q01064 1/20 0.30
PDE1C Q14123 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
SCHEMBL16386821 0.87 SLC13A5 (0.40) ALDH1A1KDM4EBTKSMN1; SMN2SLC13A5
SCHEMBL18371936 0.85 APP (0.35) ALDH1A1KDM4ESLC13A5TRPV1GAA
SCHEMBL15292546 0.78 PIK3R1 (0.36) ALDH1A1SLC13A5LMNAGAA
SCHEMBL19055602 0.78 NPSR1 (0.38) ALDH1A1SMN1; SMN2NPSR1LMNAKMT2A
SCHEMBL18371947 0.77 PTGS2 (0.36) ALDH1A1KDM4ERXRAKMT2A
SCHEMBL12037985 0.75 SSTR4 (0.39) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL20795396 0.75 MAPT (0.40) ALDH1A1KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL19819860 0.75 SLC13A5 (0.42) ALDH1A1KDM4ENPC1RAB9ABTK
SCHEMBL18371940 0.74 LPAR1 (0.37) RXRAGAA
SCHEMBL31652221 0.72 ALDH1A1 (0.34) ALDH1A1KDM4ENPC1RAB9ASLC13A5

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-9896441-B2 Tetrahydroquinoline sulfonamide and related compounds for use as agonists of RORγ and the treatment of disease LYCERA CORPORATION (US) 2018-02-20 US disclosed
US-20170183331-A1 TETRAHYDROQUINOLINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORy AND THE TREATMENT OF DISEASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2017-06-29 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-20170183331-A1 TETRAHYDROQUINOLINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORy AND THE TREATMENT OF DISEASE RORA, RORB, RORC ALDH1A1 602/4885KDM4E 3127/4885NPC1 978/4885

“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.