SCHEMBL19040384

SCHEMBL19040384

Cc1cnc(OCCO)c(SCc2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
POLB P06746 3/20 0.39
HTT P42858 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.37
PKM P14618 1/20 0.37
SCN9A Q15858 1/20 0.37
KDM4E B2RXH2 3/20 0.37
LMNA P02545 3/20 0.37
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
HPGD P15428 2/20 0.36
PPARG P37231 2/20 0.36
NCOA2 Q15596 2/20 0.36
NCOA1 Q15788 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2C19 P33261 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
CYP2C9 P11712 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL19040354 0.85 NR2E3 (0.41) ALDH1A1POLBHTTL3MBTL1PKM
SCHEMBL18601042 0.84 MEN1 (0.46) ALDH1A1POLBHTTL3MBTL1PKM
SCHEMBL19040383 0.84 ALDH1A1 (0.39) ALDH1A1HTTL3MBTL1PKMKDM4E
SCHEMBL19040394 0.82 LMNA (0.41) ALDH1A1POLBHTTL3MBTL1PKM
SCHEMBL18601031 0.81 CYP11B1 (0.40) ALDH1A1L3MBTL1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL25227297 0.77 SCN9A (0.50) ALDH1A1POLBHTTL3MBTL1PKM
SCHEMBL19040395 0.77 ADORA3 (0.37) ALDH1A1HTTL3MBTL1PKMKDM4E
SCHEMBL19040396 0.73 CA12 (0.33) ALDH1A1POLBHTTL3MBTL1PKM
SCHEMBL18601001 0.71 KMT2A (0.46) ALDH1A1L3MBTL1PKMKDM4EKMT2A
SCHEMBL20304701 0.70 NR2E3 (0.40) ALDH1A1POLBHTTL3MBTL1PKM

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-20180208587-A1 TETRAHYDROQUINOLINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORy AND THE TREATMENT OF DISEASE LYCERA CORPORATION 2018-07-26 US disclosed
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 (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-20170183331-A1 TETRAHYDROQUINOLINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORy AND THE TREATMENT OF DISEASE RORA, RORB, RORC ALDH1A1 602/4885POLB 4352/4885HTT 1495/4885
US-20180208587-A1 TETRAHYDROQUINOLINE SULFONAMIDE AND RELATED COMPOUNDS FOR USE AS AGONISTS OF RORy AND THE TREATMENT OF DISEASE RORA, RORB, RORC ALDH1A1 602/4885POLB 4352/4885HTT 1495/4885

“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.