SCHEMBL25683450

SCHEMBL25683450

CCCc1cccc2c1sc1c2ccc2c1c1ccccc1n2C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.40
▸ UTS2R Q9UKP6 1/20 0.39
▸ NQO2 P16083 1/20 0.39
▸ MAPT P10636 5/20 0.38
▸ HTT P42858 4/20 0.38
▸ NPEPPS P55786 1/20 0.37
▸ KDM4E B2RXH2 7/20 0.35
▸ ALDH1A1 P00352 5/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ GABRP O00591 1/20 0.34
▸ GABRD O14764 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRB1 P18505 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ GABRA3 P34903 1/20 0.34
▸ GABRA2 P47869 1/20 0.34
▸ GABRB2 P47870 1/20 0.34

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
SCHEMBL25683445 0.87 UTS2R (0.38) GPR3UTS2RNQO2MAPTHTT
SCHEMBL25684450 0.85 GPR3 (0.39) GPR3UTS2RNQO2MAPTHTT
SCHEMBL25683512 0.83 GPR3 (0.37) GPR3UTS2RNQO2MAPTHTT
SCHEMBL25684081 0.82 ALKBH5 (0.46) GPR3MAPTHTTNPEPPSKDM4E
SCHEMBL25683518 0.80 MAPT (0.35) GPR3MAPTHTTNPEPPSKDM4E
SCHEMBL15497405 0.79 CYP1A2 (0.33) KDM4EALDH1A1GABRA1GABRB2CYP1A2
SCHEMBL25683449 0.78 HPGD (0.39) GPR3UTS2RNQO2MAPTHTT
SCHEMBL25998159 0.77 GPR3 (0.39) GPR3UTS2RNQO2MAPTHTT
SCHEMBL25683447 0.77 HPGD (0.38) GPR3UTS2RNQO2MAPTHTT
SCHEMBL13183789 0.77 GPR3 (0.47) GPR3UTS2RNQO2MAPTHTT

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 GPR3 1535/4885UTS2R 4281/4885NQO2 1364/4885
US-20170158683-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 GPR3 2697/4885UTS2R 3414/4885NQO2 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.

Send feedback