SCHEMBL31508012

SCHEMBL31508012

C[C@@H]1CCCN1c1cnc(N)cn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMPD3 Q9NY59 2/20 0.48
LRRK2 Q5S007 3/20 0.45
JAK3 P52333 2/20 0.43
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
PBRM1 Q86U86 8/20 0.39
SMARCA2 P51531 5/20 0.39
SMARCA4 P51532 4/20 0.39
NR1I2 O75469 2/20 0.39
NR1H2 P55055 1/20 0.39
MAP3K12 Q12852 1/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL31507954 1.00 SMPD3 (0.48) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL24092755 0.95 ALDH1A1 (0.45) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL27307882 0.80 SMPD3 (0.42) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL26633307 0.79 SMPD3 (0.50) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL26633305 0.79 SMPD3 (0.50) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL24548234 0.79 CHRNB2 (0.44) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL29739626 0.79 CHRNB2 (0.44) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL24548206 0.79 CHRNB2 (0.44) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL29177381 0.79 CHRNB2 (0.44) SMPD3LRRK2JAK3MEN1ALDH1A1
SCHEMBL26633302 0.79 SMPD3 (0.50) SMPD3LRRK2JAK3MEN1ALDH1A1

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-12384773-B2 Thiazole compounds and methods of use thereof ARCUS BIOSCIENCES, INC. (US) 2025-08-12 US disclosed
WO-2025096979-A1 THIAZOLE COMPOUNDS AS KIT INHIBITORS AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2025-05-08 WO disclosed
US-20250145606-A1 THIAZOLE COMPOUNDS AND METHODS OF USE THEREOF ARCUS BIOSCIENCES, INC. (US) 2025-05-08 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-12384773-B2 Thiazole compounds and methods of use thereof TPMT, CYP11B2, ABAT SMPD3 2484/4885LRRK2 2153/4885JAK3 302/4885
US-20250145606-A1 THIAZOLE COMPOUNDS AND METHODS OF USE THEREOF TPMT, CYP11B2, ABAT SMPD3 2484/4885LRRK2 2153/4885JAK3 302/4885

“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.