SCHEMBL25997461

SCHEMBL25997461

CCCCc1cccc2c1c1c3c(ccc1n2C)sc1ccccc13

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 1/20 0.36
SLC2A1 P11166 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
UTS2R Q9UKP6 1/20 0.36
PTPN1 P18031 2/20 0.35
CNR2 P34972 6/20 0.34
CNR1 P21554 2/20 0.33
F12 P00748 1/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
GPR3 P46089 1/20 0.33
NPC1 O15118 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL25998128 0.93 GPR3 (0.38) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25997195 0.84 KDM4E (0.36) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL4250331 0.83 GPR3 (0.47) CYP2D6SMN1; SMN2PTPN1CNR2CNR1
SCHEMBL25998159 0.81 GPR3 (0.39) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25682734 0.80 RORA (0.42) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25684319 0.79 ALKBH5 (0.33) KDM4ECYP1A2HTTUTS2RCNR2
SCHEMBL25997238 0.79 KDM4E (0.38) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL5591011 0.79 GPR3 (0.45) PTPN1CNR2CNR1GPR3
SCHEMBL25683785 0.78 ALKBH5 (0.35) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL9299449 0.77 LIPG (0.46) PTPN1CNR2CNR1FAAHMGLL

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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT KYULUX, INC. (JP) 2023-08-24 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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT CRY1, CCNE2, CRY2 KDM4E 1997/4885CYP1A2 267/4885CYP2D6 1226/4885

“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.