SCHEMBL29680778

SCHEMBL29680778

COc1ccc(CNc2ccc3oc(-c4cccnc4)nc3c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.67
KDM4E B2RXH2 11/20 0.59
ALDH1A1 P00352 7/20 0.59
NPC1 O15118 3/20 0.59
MAPK1 P28482 1/20 0.59
TSHR P16473 2/20 0.58
RAB9A P51151 3/20 0.57
RXFP1 Q9HBX9 1/20 0.56
HSD17B10 Q99714 5/20 0.55
HPGD P15428 4/20 0.55
POLB P06746 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
TP53 P04637 2/20 0.55
USP2 O75604 1/20 0.54
ESR1 P03372 1/20 0.54
NPSR1 Q6W5P4 2/20 0.53
GLA P06280 1/20 0.53

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
SCHEMBL17544214 1.00 MAPT (0.67) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL29681161 0.86 MAPT (0.73) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL17543944 0.86 MAPT (0.73) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL30402351 0.83 KDM4E (0.59) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544311 0.83 KDM4E (0.59) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544090 0.82 TSHR (0.62) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL30403273 0.82 TSHR (0.62) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL17544097 0.81 MAPT (0.66) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL30402965 0.81 MAPT (0.66) MAPTKDM4EALDH1A1NPC1MAPK1
SCHEMBL2243688 0.80 MAPT (1.00) MAPTKDM4EALDH1A1NPC1RAB9A

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-12258355-B2 Probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2025-03-25 US disclosed
US-20230212190-A1 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI FOUNDATION, INC. 2023-07-06 US disclosed
EP-4006016-A2 PROBES FOR IMAGING HUNTINGTIN PROTEIN CHDI Foundation, Inc. (US) 2022-06-01 EP 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 MAPT 8/4885KDM4E 4585/4885ALDH1A1 3976/4885
US-12258355-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 MAPT 8/4885KDM4E 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.