SCHEMBL2911210

SCHEMBL2911210

Cc1c(C)c2c(c(C)c1OCc1ccccc1)CC(C)(CN1CCN(c3ccccc3)CC1)O2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 2/20 0.37
MAPT P10636 5/20 0.37
LMNA P02545 3/20 0.37
ALDH1A1 P00352 1/20 0.37
HTT P42858 1/20 0.37
TSHR P16473 2/20 0.36
DRD2 P14416 3/20 0.36
SIGMAR1 Q99720 3/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
NFKB1 P19838 1/20 0.36
THPO P40225 1/20 0.36
HIF1A Q16665 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADRA1D P25100 1/20 0.36

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
SCHEMBL4035933 0.81 ALOX15 (0.50) DRD4MAPTLMNAALDH1A1HTT
SCHEMBL6983488 0.81 DRD2 (0.41) DRD4MAPTLMNAALDH1A1HTT
SCHEMBL6973296 0.80 USP2 (0.42) MAPTLMNAALDH1A1TSHRDRD2
SCHEMBL6973300 0.80 USP2 (0.42) MAPTLMNAALDH1A1TSHRDRD2
SCHEMBL6974891 0.78 TP53 (0.41) MAPTLMNAALDH1A1TSHRDRD2
SCHEMBL6974885 0.78 TP53 (0.41) MAPTLMNAALDH1A1TSHRDRD2
SCHEMBL6967506 0.78 HTR6 (0.40) MAPTLMNATSHRDRD2SIGMAR1
SCHEMBL6967502 0.78 HTR6 (0.40) MAPTLMNATSHRDRD2SIGMAR1
SCHEMBL6985836 0.78 DRD2 (0.40) DRD4MAPTLMNAALDH1A1HTT
Hydrochloric Acid SCHEMBL6980227 0.77 DRD2 (0.40) DRD4MAPTLMNAALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1481679-B1 ANTIDEPRESSANT TAKEDA PHARMACEUTICAL (JP) 2010-08-25 EP disclosed
US-7750037-B2 Antidepressant TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-07-06 US disclosed
EP-1323716-B1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS TAKEDA PHARMACEUTICAL (JP) 2009-01-14 EP disclosed
US-20090012081-A1 Agents for promoting the proliferation or differentiation of stem cells or neural progenitor cells TAKEDA PHARMACEUTICAL COMPANY LTD. (JP) 2009-01-08 US disclosed
US-20060241168-A1 Antidepressant OHKAWA SHIGENORI 2006-10-26 US disclosed
US-7008950-B1 Benzofurans as suppressors of neurodegeneration TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2006-03-07 US disclosed
US-20050148650-A1 Antidepressant TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-07-07 US disclosed
EP-1481679-A1 ANTIDEPRESSANT Takeda Chemical Industries, Ltd. (JP) 2004-12-01 EP disclosed
US-20040034049-A1 Promoters for the proliferation and differentiation of stem cells and/or neuron precursor cells TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-02-19 US disclosed
EP-1323716-A1 PROMOTERS FOR THE PROLIFERATION AND DIFFERENTIATION OF STEM CELLS AND/OR NEURON PRECURSOR CELLS Takeda Chemical Industries, Ltd. (JP) 2003-07-02 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 (4 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-20050148650-A1 Antidepressant AKT1S1, AKT1, AKT2 DRD4 299/4885MAPT 3659/4885LMNA 1435/4885
US-20060241168-A1 Antidepressant AKT1S1, AKT1, AKT2 DRD4 299/4885MAPT 3659/4885LMNA 1435/4885
US-20090012081-A1 Agents for promoting the proliferation or differentiation of stem cells or neural progenitor cells NES, MKI67, CCNO DRD4 1756/4885MAPT 4127/4885LMNA 1938/4885
US-20040034049-A1 Promoters for the proliferation and differentiation of stem cells and/or neuron precursor cells NES, HAT1, PROX1 DRD4 934/4885MAPT 4443/4885LMNA 1890/4885

“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.