SCHEMBL4473196

SCHEMBL4473196

COc1c(C)c(C)c2c(c1C)C(=O)C1(CCC1)CN2c1ccc(Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HSD11B1 P28845 1/20 0.31
MAPT P10636 2/20 0.30
AMY1A P0DUB6 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SIGMAR1 Q99720 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MIF P14174 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
SCHEMBL4466246 0.85 HSD11B1 (0.32) RAB9AHSD11B1MAPTALDH1A1SMN1; SMN2
SCHEMBL4473145 0.82 DOCK5 (0.34) RAB9AHSD11B1MAPTAMY1AALDH1A1
SCHEMBL4462793 0.75 CYP11B2 (0.31)
SCHEMBL4478379 0.74 LMNA (0.34) HSD11B1SMN1; SMN2MEN1KMT2A
SCHEMBL4470762 0.60 CYP11B2 (0.34)
SCHEMBL4472455 0.59 SPR (0.34) SMN1; SMN2MEN1KMT2A
SCHEMBL4727877 0.58 NPC1 (0.78) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL8791216 0.57 SMN1; SMN2 (0.81) RAB9AHSD11B1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL242117 0.55 OPRL1 (0.45) MAPTMEN1KMT2A
SCHEMBL25676813 0.55 RAB9A (0.44) NPC1RAB9AALDH1A1SMN1; SMN2KDM4E

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 NPC1 1135/4885RAB9A 3169/4885HSD11B1 117/4885

“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.