SCHEMBL31664593

SCHEMBL31664593

CN(CC1COCc2c(-c3ccc(F)cc3)cccc21)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
HTR1A P08908 1/20 0.36
HTR7 P34969 1/20 0.36
GRM2 Q14416 1/20 0.35
IDH1 O75874 1/20 0.35
HTR2C P28335 3/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
KCNA5 P22460 1/20 0.34
KCNH2 Q12809 1/20 0.34
DRD1 P21728 4/20 0.33
SLC6A4 P31645 3/20 0.33
HTR2A P28223 1/20 0.33
MLNR O43193 2/20 0.32
PDK2 Q15119 1/20 0.32
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
PTK2 Q05397 1/20 0.31

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
SCHEMBL31664591 1.00 BRD4 (0.36) BRD4CREBBPHTR1AHTR7GRM2
SCHEMBL31664596 0.88 BRD4 (0.35) BRD4CREBBPIDH1KCNA5JAK2
SCHEMBL30782852 0.82 BRD4 (0.34) BRD4CREBBPHTR2CSLC6A4PDK2
SCHEMBL30782903 0.82 BRD4 (0.34) BRD4CREBBPHTR2CSLC6A4PDK2
SCHEMBL30782883 0.82 PARP15 (0.35) IDH1HTR2CKCNH2SLC6A4PDK2
SCHEMBL30782833 0.82 PARP15 (0.35) IDH1HTR2CKCNH2SLC6A4PDK2
SCHEMBL30782862 0.81 GRM5 (0.34)
SCHEMBL30782909 0.81 GRM5 (0.34)
SCHEMBL31664598 0.80 HTR1A (0.38) BRD4CREBBPHTR1AHTR7GRM2
SCHEMBL29923155 0.80 BRD4 (0.36) BRD4CREBBPHTR1AHTR7GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250236602-A1 COMPOUNDS FOR THE TREATMENT OF A CENTRAL NERVOUS SYSTEM DISEASE OR DISORDER CORETERRA THERAPEUTICS, INC. 2025-07-24 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-20250236602-A1 COMPOUNDS FOR THE TREATMENT OF A CENTRAL NERVOUS SYSTEM DISEASE OR DISORDER PMP22, INA, SLC18A2 BRD4 1824/4885CREBBP 1531/4885HTR1A 839/4885

“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.