SCHEMBL4464641

SCHEMBL4464641

Cc1cc(SC2(CC(=O)O)CCC2)cc(C)c1O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
NPC1 O15118 1/20 0.36
HMGB1 P09429 1/20 0.32
CXCL12 P48061 1/20 0.32
MAPT P10636 1/20 0.31
XBP1 P17861 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2B6 P20813 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL618046 0.76 FFAR1 (0.41) KMT2ANPC1CXCL12
SCHEMBL7310236 0.69 HSD11B1 (0.44) KMT2AMEN1NPC1MAPTCA1
SCHEMBL15346698 0.67 CYP2C19 (0.40) KMT2ACYP1A2
SCHEMBL7303726 0.65 ALDH1A1 (0.44) KMT2AMEN1MAPT
SCHEMBL7307399 0.64 ALDH1A1 (0.43) KMT2AMEN1MAPT
SCHEMBL9637668 0.64 ALDH1A1 (0.40) CYP1A2
SCHEMBL2921654 0.63 HMGB1 (0.52) HMGB1CXCL12MAPTCA1CA2
SCHEMBL6516217 0.59 HPGD (0.62)
SCHEMBL17285639 0.59 MEN1 (0.51) KMT2AMEN1NPC1HMGB1CXCL12
SCHEMBL8668939 0.59 CA1 (0.55) ACHEKMT2AMEN1NPC1MAPT

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-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed
EP-1836183-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS Galileo Pharmaceuticals, Inc. (US) 2007-09-26 EP disclosed
WO-2006065686-A2 SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS GALILEO PHARMACEUTICALS, INC. (US) 2006-06-22 WO disclosed
US-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors GALILEO PHARMACEUTICALS, INC. 2006-06-15 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-20060128790-A1 Spiro derivatives as lipoxygenase inhibitors ALOX15B, ALOX5, ALOX15 ACHE 3505/4885KMT2A 3967/4885MEN1 4420/4885

“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.