SCHEMBL29323202

SCHEMBL29323202

O=C(CN1CCN2c3cccc4scc(c34)CC2C1)c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HPGD P15428 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ DRD2 P14416 6/20 0.39
▸ GAA P10253 2/20 0.37
▸ HTR2A P28223 2/20 0.37
▸ NSD2 O96028 1/20 0.37
▸ ALPL P05186 1/20 0.37
▸ HTR2C P28335 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37

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
SCHEMBL29323243 0.89 DRD3 (0.61) DRD3ALDH1A1TSHRDRD2HTR2A
SCHEMBL29323246 0.84 HTR2A (0.49) DRD3DRD2HTR2AHTR2CSLC6A4
SCHEMBL30179301 0.81 DRD2 (0.44) DRD3DRD2KCNH2
SCHEMBL28967717 0.81 DRD2 (0.44) DRD3DRD2KCNH2
SCHEMBL29325534 0.81 DRD3 (0.41) DRD3DRD2HTR2ASLC6A4
SCHEMBL29325061 0.80 DRD2 (0.46) DRD3DRD2
SCHEMBL30179173 0.78 DRD2 (0.48) DRD3MAPTDRD2
SCHEMBL29322785 0.78 DRD2 (0.48) DRD3MAPTDRD2
SCHEMBL29324627 0.78 DRD2 (0.61) DRD3MAPTDRD2
SCHEMBL29324093 0.78 DRD2 (0.50) DRD3DRD2

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-20240383913-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF SHANGHAITECH UNIVERSITY (CN) 2024-11-21 — — US disclosed
EP-4400504-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Center for Excellence in Molecular Cell Science, Chinese Academy of Sciences (CN) 2024-07-17 — — EP disclosed
CN-115772175-A Thieno-ring compounds, process for their preparation and their use 中国科学院分子细胞科学卓越创新中心 2023-03-10 — — CN 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-20240383913-A1 THIOPHENE RING COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF TACR1, HTR1F, TPH1 DRD3 198/4885ALDH1A1 687/4885KDM4E 3575/4885

“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