SCHEMBL17464751

SCHEMBL17464751

CC1CC(Cn2ccc3cc(-c4cn[nH]c4)ccc32)CCN1S(=O)(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.40
ABCB1 P08183 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GRM2 Q14416 1/20 0.35
ACP1 P24666 1/20 0.35
SMYD3 Q9H7B4 4/20 0.35
WNT1 P04628 1/20 0.34
GSK3B P49841 1/20 0.34
DYRK1A Q13627 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DRD3 P35462 1/20 0.34

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
SCHEMBL17464748 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17458579 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17458511 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17464736 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17458568 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17458583 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17458535 0.93 HTR6 (0.41) HTR6ABCB1HRH3POLBL3MBTL1
SCHEMBL17464752 0.88 SMYD3 (0.39) HRH3POLBGRM2SMYD3
SCHEMBL17458593 0.86 HTR6 (0.44) HTR6ABCB1POLBL3MBTL1GRM2
SCHEMBL17458585 0.85 KDM1A (0.38) HTR6HRH3L3MBTL1GRM2WNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9701663-B2 Sulfonamide retinoic acid receptor-related orphan receptor modulators and uses thereof INNOV17 LLC (US) 2017-07-11 US disclosed
US-9701663-B2 Sulfonamide retinoic acid receptor-related orphan receptor modulators and uses thereof INNOV17 LLC (US) 2017-07-11 US disclosed
WO-2016014910-A1 SULFONAMIDE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC (US) 2016-01-28 WO disclosed
US-20160024056-A1 SULFONAMIDE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC 2016-01-28 US disclosed
US-20160024056-A1 SULFONAMIDE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC 2016-01-28 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-20160024056-A1 SULFONAMIDE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF RARA, RARB, RXRA HTR6 2847/4885ABCB1 1785/4885HRH3 2022/4885

“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.