SCHEMBL2959968

SCHEMBL2959968

CC(C)(C)OC(=O)N1CCCC(CN2CCN(Cc3ccccc3)CC2)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 4/20 0.54
BCHE P06276 2/20 0.54
ACKR3 P25106 1/20 0.52
USP30 Q70CQ3 2/20 0.49
FEN1 P39748 1/20 0.49
CCR2 P41597 1/20 0.48
KCNH2 Q12809 1/20 0.48
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
GPR119 Q8TDV5 1/20 0.48
KDM1A O60341 1/20 0.47
GRM5 P41594 1/20 0.47
GRM7 Q14831 1/20 0.47
GRM3 Q14832 1/20 0.47
TP53 P04637 2/20 0.47
THRB P10828 1/20 0.47
MAPT P10636 1/20 0.47
MEN1 O00255 1/20 0.46
TSHR P16473 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL2959964 1.00 HTR6 (0.54) HTR6BCHEACKR3USP30FEN1
SCHEMBL641207 0.93 KDM4E (0.52) HTR6BCHEJAK2JAK1GPR119
SCHEMBL641206 0.93 KDM4E (0.52) HTR6BCHEJAK2JAK1GPR119
SCHEMBL642365 0.93 KDM4E (0.52) HTR6BCHEJAK2JAK1GPR119
SCHEMBL5249398 0.88 PARP1 (0.50) HTR6BCHEACKR3USP30FEN1
SCHEMBL1780154 0.88 PARP1 (0.50) HTR6BCHEACKR3USP30FEN1
SCHEMBL20274773 0.86 TP53 (0.50) GPR119TP53THRBMAPTMEN1
SCHEMBL14497204 0.86 KDM4E (0.51) CCR2KCNH2JAK2JAK1GPR119
SCHEMBL23270010 0.85 TP53 (0.53) BCHEGPR119TP53THRBMAPT
SCHEMBL8237687 0.84 ACKR3 (0.57) HTR6BCHEACKR3USP30FEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767681-B2 2-Carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2010-08-03 US disclosed
US-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof SANOFI-AVENTIS (FR) 2007-08-02 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-20070179126-A1 2-carbamide-4-phenylthiazole derivatives, preparation thereof and therapeutic use thereof UGT2B7, PKD2, CYP2C19 HTR6 2224/4885BCHE 184/4885ACKR3 4345/4885

“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.