SCHEMBL17464705

SCHEMBL17464705

Cc1cc(S(=O)(=O)N2CCC(Cn3ccc4cc(-c5cn[nH]c5)ccc43)CC2)ccn1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.38
ATM Q13315 1/20 0.37
TP53 P04637 2/20 0.37
THRB P10828 1/20 0.36
PIK3C3 Q8NEB9 2/20 0.36
GRM2 Q14416 2/20 0.35
POLB P06746 1/20 0.35
WNT3A P56704 1/20 0.35
LRRK2 Q5S007 1/20 0.35

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
SCHEMBL17464753 0.89 TP53 (0.39) ATMTP53THRBGRM2POLB
SCHEMBL17464712 0.89 HTR6 (0.42) CNR2ATMTP53THRBGRM2
SCHEMBL17458536 0.87 TP53 (0.39) ATMTP53GRM2POLB
SCHEMBL17458593 0.86 HTR6 (0.44) GRM2POLB
SCHEMBL17464759 0.85 TP53 (0.37) ATMTP53THRBGRM2POLB
SCHEMBL17458566 0.85 THRB (0.47) TP53THRB
SCHEMBL17458548 0.85 LRRK2 (0.45) PIK3C3GRM2LRRK2
SCHEMBL17458595 0.84 KDM4E (0.43) CNR2POLB
SCHEMBL17458587 0.84 LMNA (0.40) ATMTP53GRM2POLB
SCHEMBL17458574 0.84 ALDH1A1 (0.41) ATMTP53

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
US-20160024056-A1 SULFONAMIDE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC 2016-01-28 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

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 CNR2 633/4885ATM 4697/4885TP53 2666/4885

“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.