SCHEMBL4164482

SCHEMBL4164482

COc1ccccc1C=C1c2ccccc2CCc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.56
ALDH1A1 P00352 5/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
GAA P10253 2/20 0.56
KDM4E B2RXH2 1/20 0.56
NPC1 O15118 2/20 0.52
MIF P14174 2/20 0.50
SMN1; SMN2 Q16637 6/20 0.47
RAB9A P51151 2/20 0.47
PLA2G1B P04054 1/20 0.47
ATG4B Q9Y4P1 1/20 0.47
KMT2A Q03164 3/20 0.47
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 5/20 0.45
HTT P42858 2/20 0.45
CASP3 P42574 2/20 0.45
SENP8 Q96LD8 2/20 0.45
SENP7 Q9BQF6 2/20 0.45
SENP6 Q9GZR1 2/20 0.45

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
SCHEMBL4163391 0.88 ALDH1A1 (0.55) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL4163584 0.86 MAPT (0.44) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL28575654 0.84 NPC1 (0.59) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL4158016 0.83 MAPT (0.53) MAPTALDH1A1L3MBTL1KDM4ENPC1
SCHEMBL4163664 0.83 MAPT (0.68) MAPTALDH1A1L3MBTL1GAANPC1
SCHEMBL4159194 0.82 MAPT (0.45) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL4157916 0.82 MAPT (0.45) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL4159205 0.80 DRD1 (0.43) MAPTALDH1A1L3MBTL1GAAKDM4E
SCHEMBL4160618 0.77 MAPT (0.56) MAPTALDH1A1KDM4ENPC1MIF
SCHEMBL4155408 0.76 MAPT (0.69) MAPTALDH1A1L3MBTL1GAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS COGHLAN MICHAEL JOSEPH 2009-06-11 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-7411072-B2 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY (US) 2008-08-12 US disclosed
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators ELI LILLY AND COMPANY 2006-03-23 US disclosed
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 WO 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-20090149445-A1 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS NR5A1, NR3C2, NR3C1 MAPT 3591/4885ALDH1A1 1812/4885L3MBTL1 4870/4885
US-20060063759-A1 Tricyclic steroid hormone nuclear receptor modulators NR5A1, NR3C2, NR3C1 MAPT 3416/4885ALDH1A1 1728/4885L3MBTL1 4872/4885

“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.