SCHEMBL926562

SCHEMBL926562

CC(C)(C)c1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(=O)NCCOc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
POLB P06746 1/20 0.50
CASP3 P42574 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
MMP8 P22894 2/20 0.44
MMP3 P08254 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.42
PKM P14618 2/20 0.42
PTGER3 P43115 1/20 0.42
LMNA P02545 1/20 0.42
GLA P06280 1/20 0.42
HTT P42858 1/20 0.42
EPHX2 P34913 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
RORC P51449 1/20 0.41
XBP1 P17861 1/20 0.41

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
SCHEMBL927317 0.94 NPC1 (0.48) NPC1RAB9APOLBCASP3SENP7
SCHEMBL926278 0.93 MMP8 (0.44) NPC1RAB9APOLBCASP3SENP7
SCHEMBL926649 0.91 MMP8 (0.44) NPC1RAB9APOLBCASP3SENP7
SCHEMBL927561 0.89 ALDH1A1 (0.44) NPC1RAB9APOLBCASP3SENP7
SCHEMBL927615 0.89 GPR35 (0.42) NPC1RAB9APOLBCASP3SENP7
SCHEMBL926338 0.86 FKBP1A (0.49) NPC1RAB9AALDH1A1NPSR1KMT2A
SCHEMBL929036 0.86 ALDH1A1 (0.44) POLBALDH1A1NPSR1MMP8MMP3
SCHEMBL927527 0.85 FKBP1A (0.48) NPC1RAB9APOLBALDH1A1NPSR1
SCHEMBL927124 0.85 RAB9A (0.46) NPC1RAB9APOLBCASP3SENP7
SCHEMBL926201 0.85 MAPT (0.44) ALDH1A1NPSR1MMP8MMP3SMN1; SMN2

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-7872021-B2 LXR receptor modulators LABORATORIES FOURNIER S.A. (FR) 2011-01-18 US disclosed
US-20070099960-A1 LXR receptor modulators LABORATOIRES FOURNIER S.A. (FR) 2007-05-03 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-20070099960-A1 LXR receptor modulators NR1H2, NR1H3, PPARD NPC1 43/4885RAB9A 3853/4885POLB 3286/4885

“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.