SCHEMBL4182109

SCHEMBL4182109

O=C(NC1CC1)c1ccno1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
NPC1 O15118 1/20 0.46
UTS2R Q9UKP6 1/20 0.46
GAA P10253 2/20 0.45
HPGD P15428 3/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.44
GFER P55789 1/20 0.43
ACKR3 P25106 1/20 0.43
CSF1R P07333 1/20 0.43
HDAC4 P56524 1/20 0.43

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
SCHEMBL30343658 0.79 KEAP1 (0.42) KMT2AMEN1KEAP1NFE2L2NPC1
SCHEMBL13342094 0.77 TAS1R3 (0.52)
SCHEMBL13212367 0.77 TAS1R3 (0.52)
SCHEMBL18425647 0.77 KEAP1 (0.41) KMT2AMEN1KEAP1NFE2L2NPC1
SCHEMBL18425646 0.77 KEAP1 (0.41) KMT2AMEN1KEAP1NFE2L2NPC1
SCHEMBL6867850 0.76 KMT5B (0.60) KMT2AMEN1NPC1HPGDALDH1A1
SCHEMBL27520450 0.74 KMT2A (0.47) KMT2AMEN1KEAP1NFE2L2GAA
SCHEMBL353475 0.73
SCHEMBL2574566 0.73
SCHEMBL17926698 0.73 KEAP1 (0.38) KMT2AMEN1KEAP1NFE2L2UTS2R

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
WO-2006016237-A2 HETEROCYCLIC DERIVATIVES AS ANTI-INFLAMMATORY AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-02-16 WO claimed
US-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF VENTUS THERAPEUTICS U.S., INC. (US) 2025-01-02 US disclosed
US-20230101819-A1 SMYD Inhibitors EPIZYME INC (US) 2023-03-30 US disclosed
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRUENENTHAL GMBH (DE) 2009-03-12 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 (3 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-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF CGAS, TDP1, CYP11B2 KMT2A 4398/4885MEN1 69/4885KEAP1 2174/4885
US-20090069320-A1 Substituted 4-Amino-Quinazoline Compounds with Metabotropic Glutamate Receptor Regulating Activity and Uses Thereof GRM1, GRIN1, GRM2 KMT2A 1642/4885MEN1 4274/4885KEAP1 2152/4885
US-20230101819-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 KMT2A 364/4885MEN1 3330/4885KEAP1 2593/4885

“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.