SCHEMBL5841833

SCHEMBL5841833

CCn1c2ccccc2c2cc(NC(=O)C3CC(=O)N(Cc4ccc(OC)cc4OC)C3)ccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.53
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 5/20 0.53
RAB9A P51151 3/20 0.53
NPSR1 Q6W5P4 3/20 0.53
POLB P06746 2/20 0.53
MAPK1 P28482 1/20 0.53
KDM4E B2RXH2 10/20 0.51
HPGD P15428 8/20 0.51
LMNA P02545 7/20 0.51
SMN1; SMN2 Q16637 6/20 0.51
HCRTR1 O43613 3/20 0.51
NPC1 O15118 1/20 0.51
PAX8 Q06710 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HTT P42858 2/20 0.49

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
SCHEMBL27599294 0.92 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL6610441 0.88 MAPT (0.52) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5841477 0.84 NPSR1 (0.52) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5841838 0.84 MAPT (0.53) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5842282 0.83 ALDH1A1 (0.64) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL27599166 0.82 POLB (0.64) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5841644 0.82 MAPT (0.61) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5842278 0.81 MAPT (0.54) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5843034 0.81 ALDH1A1 (0.56) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5842037 0.79 MAPT (0.57) MAPTMEN1KMT2AALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067549-B2 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2006-06-27 US claimed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 US claimed
US-7067549-B2 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2006-06-27 US disclosed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 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-20050192292-A1 Pyrrolidone carboxamides NPY1R, NPY5R, NPY2R MAPT 4395/4885MEN1 3619/4885KMT2A 3347/4885

“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.