SCHEMBL25997380

SCHEMBL25997380

CCCCc1ccc2c(c1)sc1c2ccc2c3ccccc3n(C)c21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ SLC2A1 P11166 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ALKBH5 Q6P6C2 1/20 0.38
▸ FTO Q9C0B1 1/20 0.38
▸ RORA P35398 2/20 0.37
▸ RORC P51449 2/20 0.37
▸ RORB Q92753 2/20 0.37
▸ HPGD P15428 3/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ CNR2 P34972 2/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ TSHR P16473 1/20 0.35
▸ GPR3 P46089 1/20 0.35
▸ ESR1 P03372 1/20 0.35

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
SCHEMBL25684080 0.94 ALKBH5 (0.40) KDM4EHTTALKBH5FTOHPGD
SCHEMBL25997353 0.89 RORA (0.44) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25684079 0.85 ALKBH5 (0.39) KDM4EHTTALKBH5FTORORA
SCHEMBL25683980 0.85 HPGD (0.41) KDM4EALKBH5FTOHPGDALDH1A1
SCHEMBL25683981 0.83 RORA (0.39) KDM4ERORARORCRORBHPGD
SCHEMBL25682510 0.82 KDM4E (0.43) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25682708 0.82 KDM4E (0.43) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25997311 0.80 KDM4E (0.40) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL25682647 0.79 ALKBH5 (0.43) KDM4ECYP1A2CYP2D6SLC2A1HTT
SCHEMBL13183677 0.79 ALKBH5 (0.50) KDM4EHTTSMN1; SMN2ALKBH5FTO

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.

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