SCHEMBL31709596

SCHEMBL31709596

CCc1cc(Br)nc(Cl)c1N

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
HTR6 P50406 1/20 0.30
KDM4E B2RXH2 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL28972297 0.80 SMN1; SMN2 (0.39) HTTPOLBALDH1A1MAPTNOS3
SCHEMBL22696331 0.80 SMN1; SMN2 (0.39) HTTPOLBALDH1A1MAPTNOS3
SCHEMBL20075810 0.80 HTT (0.38) HTTPOLBALDH1A1MAPTNOS3
SCHEMBL18398496 0.77 HTT (0.36) HTTPOLBALDH1A1MAPTNOS3
SCHEMBL29759333 0.74 ALDH1A1 (0.42) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL4663299 0.74 ALDH1A1 (0.42) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL20075807 0.74 HTR6 (0.35) HTTPOLBNOS3NOS1NOS2
SCHEMBL3208148 0.74 CYP3A4 (0.37) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL31206751 0.74 CYP3A4 (0.37) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL22715880 0.73 CYP1A2 (0.36) ALDH1A1MAPTSMN1; SMN2HTR6KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250340551-A1 SMALL MOLECULE MODULATORS OF STAT6 GILEAD SCIENCES INC (US) 2025-11-06 US disclosed
US-20250325677-A1 STAT6 DEGRADERS GILEAD SCIENCES INC (US) 2025-10-23 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-20250325677-A1 STAT6 DEGRADERS STAT6, STAT5B, STAT1 HTT 1112/4885POLB 3003/4885ALDH1A1 959/4885
US-20250340551-A1 SMALL MOLECULE MODULATORS OF STAT6 STAT6, STAT1, STAT5B HTT 2728/4885POLB 3678/4885ALDH1A1 2050/4885

“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.