SCHEMBL4513451

SCHEMBL4513451

CC(C)(C)OC(=O)N(CC(=O)Nc1ccccc1)C1CC1N

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
LTA4H P09960 1/20 0.40
P2RX7 Q99572 1/20 0.39
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
KDM1A O60341 5/20 0.39
RCOR1 Q9UKL0 2/20 0.39
MAOA P21397 3/20 0.39
MAOB P27338 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL4525944 0.84 MAPT (0.36) GAAMAPTHPGDRAB9AP2RX7
SCHEMBL6657986 0.76 LTA4H (0.52) LTA4HMAOB
SCHEMBL30596225 0.76 KMT2A (0.49) GAAMAPTHPGDRAB9ASMN1; SMN2
SCHEMBL4513449 0.75 ALDH1A1 (0.44) SMN1; SMN2L3MBTL1
SCHEMBL237029 0.71 KDM1A (0.46) KDM1AMAOAMAOBSMN1; SMN2
SCHEMBL237030 0.71 KDM1A (0.46) KDM1AMAOAMAOBSMN1; SMN2
SCHEMBL2755941 0.71 KDM1A (0.46) KDM1AMAOAMAOBSMN1; SMN2
SCHEMBL9158253 0.70 MAPT (0.53) GAAMAPTHPGDRAB9AKDM1A
SCHEMBL4525941 0.69 MEN1 (0.53) GAAMAPTSMN1; SMN2L3MBTL1
SCHEMBL18067963 0.69 MAPT (0.43) GAAMAPTHPGDRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090036474-A1 Quinazoline derivatives for use against cancer PLE PATRICK 2009-02-05 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-20090036474-A1 Quinazoline derivatives for use against cancer AQP3, AQP1, F12 GAA 3392/4885MAPT 3649/4885HPGD 684/4885

“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.