SCHEMBL29680869

SCHEMBL29680869

CNCc1cccc(-c2nc3cc(OCc4ccc(OC)cn4)ccc3o2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
RAB9A P51151 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 3/20 0.46
TP53 P04637 3/20 0.46
NPC1 O15118 3/20 0.46
GLA P06280 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
PDE10A Q9Y233 2/20 0.44
MAPT P10636 3/20 0.44
TSHR P16473 2/20 0.44
MAPK1 P28482 2/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44

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
SCHEMBL17544014 1.00 ALDH1A1 (0.46) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL17553863 0.91 MAPT (0.44) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL17544284 0.89 RET (0.43) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL29681081 0.89 RET (0.43) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL19428553 0.88 ALDH1A1 (0.49) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL30427363 0.87 ALDH1A1 (0.46) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL17544101 0.87 ALDH1A1 (0.46) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL30402440 0.87 ALDH1A1 (0.53) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL17544578 0.87 ALDH1A1 (0.53) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E
SCHEMBL23633322 0.85 SMN1; SMN2 (0.58) ALDH1A1HPGDRAB9ASMN1; SMN2KDM4E

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 ALDH1A1 3976/4885HPGD 2107/4885RAB9A 1100/4885
US-12258355-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 ALDH1A1 3976/4885HPGD 2107/4885RAB9A 1100/4885

“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.