SCHEMBL3852841

SCHEMBL3852841

CC=C(CC)c1ccc2cc(C(=O)OCC)oc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.47
RAB9A P51151 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPK1 P28482 3/20 0.47
HSD17B10 Q99714 3/20 0.47
NPC1 O15118 2/20 0.47
TSHR P16473 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
MIF P14174 1/20 0.44
PFKFB3 Q16875 1/20 0.44
AKR1B1 P15121 1/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 4/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
MAOB P27338 5/20 0.43
CA12 O43570 3/20 0.43

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
SCHEMBL13714080 1.00 MAPT (0.47) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL3852840 1.00 MAPT (0.47) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL3853091 0.90 MEN1 (0.47) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL3853096 0.90 MEN1 (0.47) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL24138417 0.84 MAPT (0.51) MAPTRAB9AMEN1KMT2AMAPK1
Hydrochloric Acid SCHEMBL8712944 0.81 ITGB3 (0.50) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL1877395 0.80 MAPT (0.47) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL2246104 0.79 MAPT (0.51) MAPTRAB9AMEN1KMT2AMAPK1
SCHEMBL742193 0.78 MIF (0.68) MAPTRAB9AMEN1KMT2AHSD17B10
SCHEMBL28367859 0.78 CYP1A2 (0.50) MAPTRAB9AMEN1KMT2AMAPK1

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-7579488-B2 Vitamin D receptor modulators ELI LILLY AND COMPANY (US) 2009-08-25 US disclosed
US-20070106095-A1 Vitamin d receptor modulators ELI LILLY AND COMPANY 2007-05-10 US disclosed
EP-1687289-A1 VITAMIN D RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2006-08-09 EP disclosed
WO-2005051938-A1 VITAMIN D RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2005-06-09 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 (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-20070106095-A1 Vitamin d receptor modulators VDR, CYP2R1, CYP24A1 MAPT 4001/4885RAB9A 3789/4885MEN1 3024/4885

“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.