SCHEMBL5524286

SCHEMBL5524286

CCOC(=O)c1nn(Cc2ccccc2)c2c1CC=C2

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.52
MAPK1 P28482 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49
POLB P06746 1/20 0.49
TDP1 Q9NUW8 1/20 0.47
F2RL3 Q96RI0 1/20 0.45
MAPT P10636 1/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
HPGD P15428 1/20 0.43
TRPC5 Q9UL62 1/20 0.42
TSHR P16473 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL5525552 0.84 HPGD (0.46) POLBLMNAALDH1A1KMT2AMEN1
SCHEMBL5522868 0.82 CYP19A1 (0.53) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL5523901 0.82 MGLL (0.37) CYP19A1MAPK1SMN1; SMN2LMNAALDH1A1
SCHEMBL5528723 0.82 CCNA2 (0.42) MAPK1SMN1; SMN2POLBLMNAALDH1A1
SCHEMBL19207519 0.78 CYP19A1 (0.58) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL182381 0.78 CYP19A1 (0.53) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL10479516 0.78 CYP19A1 (0.53) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL13935668 0.77 CYP19A1 (0.50) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL27083295 0.77 CYP19A1 (0.52) CYP19A1MAPK1SMN1; SMN2POLBTDP1
SCHEMBL15075366 0.77 CYP19A1 (0.57) CYP19A1MAPK1SMN1; SMN2POLBTDP1

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-8637555-B2 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. (US) 2014-01-28 US disclosed
US-20070072924-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. 2007-03-29 US disclosed
US-20060217562-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof ARENA PHARMACEUTICALS, INC. 2006-09-28 US disclosed
EP-1683794-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof Arena Pharmaceuticals, Inc. (US) 2006-07-26 EP disclosed
EP-1599469-B1 TETRAZOLE DERIVATIVES AND METHODS OF TREATMENT OF METABOLIC-RELATED DISORDERS THEREOF ARENA PHARM INC (US) 2006-06-07 EP 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 (2 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-20070072924-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof SQLE, ACE, AGTR2 CYP19A1 477/4885MAPK1 4097/4885SMN1; SMN2 4195/4885
US-20060217562-A1 Tetrazole derivatives and methods of treatment of metabolic-related disorders thereof SQLE, ACE, AGTR2 CYP19A1 477/4885MAPK1 4097/4885SMN1; SMN2 4195/4885

“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.