SCHEMBL30403273

SCHEMBL30403273

COc1ccc(COc2ccc3oc(-c4cccnc4)nc3c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.62
KDM4E B2RXH2 10/20 0.60
ALDH1A1 P00352 7/20 0.60
NPC1 O15118 5/20 0.60
MAPK1 P28482 1/20 0.60
MAPT P10636 8/20 0.59
RAB9A P51151 4/20 0.54
CYP1A2 P05177 3/20 0.54
CYP2C19 P33261 3/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
RXFP1 Q9HBX9 1/20 0.52
SMN1; SMN2 Q16637 5/20 0.50
HPGD P15428 4/20 0.50
HSD17B10 Q99714 3/20 0.50
CYP3A4 P08684 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LMNA P02545 1/20 0.48
TP53 P04637 2/20 0.48

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
SCHEMBL17544090 1.00 TSHR (0.62) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL19432714 0.91 TSHR (0.62) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL30402827 0.91 TSHR (0.56) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544006 0.91 TSHR (0.56) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL29000655 0.89 TSHR (0.62) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL30402834 0.89 TSHR (0.64) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544341 0.89 TSHR (0.64) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544007 0.89 TSHR (0.61) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL19410514 0.89 TSHR (0.58) TSHRKDM4EALDH1A1NPC1MAPK1
SCHEMBL29681295 0.89 TSHR (0.61) TSHRKDM4EALDH1A1NPC1MAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12258355-B2 Probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2025-03-25 US disclosed
CN-116655618-A Probes for imaging huntingtin CHDI基金会股份有限公司 2023-08-29 CN disclosed
US-20230212190-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. 2023-07-06 US disclosed
CN-107108534-B Probes for imaging huntingtin CHDI基金会股份有限公司 2023-05-09 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 (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-20230212190-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN HTT, HYPK, HSPBP1 TSHR 3168/4885KDM4E 4585/4885ALDH1A1 3976/4885
US-12258355-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 TSHR 3168/4885KDM4E 4585/4885ALDH1A1 3976/4885

“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.