SCHEMBL4516864

SCHEMBL4516864

Cc1ccc(C(C)C(=O)Nn2c(C(C)C)nc3ccccc3c2=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 3/20 0.47
ALDH1A1 P00352 5/20 0.47
HPGD P15428 1/20 0.47
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 2/20 0.46
MAPT P10636 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 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
SCHEMBL30795072 1.00 GPR139 (0.47) GPR139ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL30795242 0.93 KMT2A (0.46) GPR139ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL4526768 0.93 KMT2A (0.46) GPR139ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL4519447 0.93 KMT2A (0.46) GPR139ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL30824681 0.93 KMT2A (0.46) GPR139ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL4517859 0.93 KMT2A (0.46) GPR139ALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL4527601 0.91 KMT2A (0.54) GPR139ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL30796606 0.91 KMT2A (0.54) GPR139ALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL4503557 0.90 GPR139 (0.45) GPR139ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL30795026 0.90 GPR139 (0.45) GPR139ALDH1A1SMN1; SMN2KMT2AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291973-A1 Novel Quinazoline Derivatives and Their Medical Use NEUROSEARCH A/S (DK) 2009-11-26 US claimed
WO-2024054811-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024054807-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND TDP-43 MODULATORS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-14 WO disclosed
WO-2024050389-A1 COMBINATION THERAPIES INCLUDING METAL CHANNEL ACTIVATORS AND NMDA RECEPTOR ANTAGONISTS BIOHAVEN THERAPEUTICS LTD. (VG) 2024-03-07 WO disclosed
US-20090291973-A1 Novel Quinazoline Derivatives and Their Medical Use NEUROSEARCH A/S (DK) 2009-11-26 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 (1 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-20090291973-A1 Novel Quinazoline Derivatives and Their Medical Use KCNA7, KCNN3, KCNQ5 GPR139 1959/4885ALDH1A1 3467/4885HPGD 1438/4885

“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.