SCHEMBL25683445

SCHEMBL25683445

CCCc1cccc2sc3c(ccc4c3c3ccccc3n4C)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UTS2R Q9UKP6 1/20 0.38
▸ GPR3 P46089 1/20 0.38
▸ NQO2 P16083 1/20 0.37
▸ KDM4E B2RXH2 7/20 0.36
▸ MAPT P10636 5/20 0.36
▸ HTT P42858 4/20 0.36
▸ NPEPPS P55786 1/20 0.36
▸ ALDH1A1 P00352 5/20 0.34
▸ LMNA P02545 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ SLC2A1 P11166 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRG2 P18507 1/20 0.33
▸ GABRB3 P28472 1/20 0.33

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
SCHEMBL25683512 0.91 GPR3 (0.37) UTS2RGPR3NQO2KDM4EMAPT
SCHEMBL25683450 0.87 GPR3 (0.40) UTS2RGPR3NQO2KDM4EMAPT
SCHEMBL25684450 0.86 GPR3 (0.39) UTS2RGPR3NQO2KDM4EMAPT
SCHEMBL25998159 0.86 GPR3 (0.39) UTS2RGPR3NQO2KDM4EMAPT
SCHEMBL25683518 0.85 MAPT (0.35) GPR3KDM4EMAPTHTTNPEPPS
SCHEMBL25684077 0.85 ALKBH5 (0.43) GPR3KDM4EMAPTHTTNPEPPS
SCHEMBL25997195 0.84 KDM4E (0.36) UTS2RGPR3KDM4EHTTALDH1A1
SCHEMBL13183789 0.83 GPR3 (0.47) UTS2RGPR3NQO2KDM4EMAPT
SCHEMBL25683985 0.82 MAPT (0.38) UTS2RGPR3KDM4EMAPTHTT
SCHEMBL25998128 0.82 GPR3 (0.38) UTS2RGPR3NQO2KDM4EMAPT

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 3 patents. 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
EP-4190791-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT Kyulux, Inc. (JP) 2023-06-07 — — EP disclosed
US-20170158683-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2017-06-08 — — 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 (2 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 UTS2R 4281/4885GPR3 1535/4885NQO2 1364/4885
US-20170158683-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 UTS2R 3414/4885GPR3 2697/4885NQO2 1782/4885

“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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