SCHEMBL17292018

SCHEMBL17292018

CC(C)(C)NS(=O)(=O)c1ccc(B(O)O)cc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
ENPP2 Q13822 1/20 0.36
TRPV1 Q8NER1 3/20 0.36
NSD2 O96028 2/20 0.36
PARG Q86W56 2/20 0.35
ALDH1A1 P00352 3/20 0.34
CNR1 P21554 1/20 0.32
POLB P06746 1/20 0.32
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
BRD3 Q15059 1/20 0.32

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
SCHEMBL3736629 0.79 ENPP2 (0.39) MAPTLMNASMN1; SMN2KDM4EENPP2
SCHEMBL15726865 0.77 ALDH1A1 (0.50) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL18077908 0.76 MAPT (0.41) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL13268686 0.76 SMN1; SMN2 (0.41) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL2323303 0.75 ENPP2 (0.55) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL520205 0.74 MAPT (0.65) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL15723299 0.73 CNR1 (0.40) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL26493748 0.72 CA2 (0.41) MAPTSMN1; SMN2KDM4EENPP2TRPV1
SCHEMBL6166172 0.71 ALDH1A1 (0.44) MAPTLMNASMN1; SMN2KDM4EMEN1
SCHEMBL2929280 0.70 ALDH1A1 (0.45) MAPTLMNASMN1; SMN2KDM4EMEN1

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
EP-3118189-A1 CARBOXAMIDE OR SULFONAMIDE SUBSTITUTED NITROGEN-CONTAINING 5-MEMBERED HETEROCYCLES AS MODULATORS FOR THE ORPHAN NUCLEAR RECEPTOR ROR GAMMA Phenex Pharmaceuticals AG (DE) 2017-01-18 EP disclosed
US-9458104-B2 Carboxamide or sulfonamide substituted nitrogen-containing 5-membered heterocycles as modulators for the orphan nuclear receptor RORγ PHENEX PHARMACEUTICALS AG (DE) 2016-10-04 US disclosed
US-20150344423-A1 CARBOXAMIDE OR SULFONAMIDE SUBSTITUTED NITROGEN-CONTAINING 5-MEMBERED HETEROCYCLES AS MODULATORS FOR THE ORPHAN NUCLEAR RECEPTOR ROR GAMMA PHENEX PHARMACEUTICALS AG (DE) 2015-12-03 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 (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-20150344423-A1 CARBOXAMIDE OR SULFONAMIDE SUBSTITUTED NITROGEN-CONTAINING 5-MEMBERED HETEROCYCLES AS MODULATORS FOR THE ORPHAN NUCLEAR RECEPTOR ROR GAMMA RORA, RORB, RORC MAPT 852/4885LMNA 3966/4885SMN1; SMN2 884/4885

“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.