SCHEMBL7589098

SCHEMBL7589098

COC(=O)N[C@](Cc1ccccc1)(OC)C(N)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.41
CYP3A4 P08684 2/20 0.41
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HIF1A Q16665 1/20 0.41
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TSHR P16473 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PTPN2 P17706 1/20 0.38
PTPN1 P18031 1/20 0.38
PTPRA P18433 1/20 0.38
PTPRB P23467 1/20 0.38
MMP8 P22894 1/20 0.38
F2 P00734 1/20 0.37

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
SCHEMBL6351965 0.89 CA12 (0.45) RECQLCYP3A4CYP1A2ALDH1A1MAPK1
SCHEMBL16088511 0.79 ALDH1A1 (0.61) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL8602941 0.73 ENPEP (0.53) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL11748890 0.72 CYP3A4 (0.47) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL23256417 0.70 MAPT (0.46) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL20241701 0.70 SMN1; SMN2 (0.58) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL22406298 0.70 SMN1; SMN2 (0.44) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL20241700 0.70 SMN1; SMN2 (0.58) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL8999172 0.70 MMP8 (0.54) RECQLCYP3A4CYP1A2SMN1; SMN2HIF1A
SCHEMBL6351491 0.70 CA12 (0.43) RECQLCYP3A4CYP1A2ALDH1A1MAPK1

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-20020187981-A1 Heterocyclic amines having central nervous system activity ROMERO ARTHUR GLENN (US) 2002-12-12 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 (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-20020187981-A1 Heterocyclic amines having central nervous system activity CNR1, CNR2, OPRD1 RECQL 1168/4885CYP3A4 692/4885CYP1A2 324/4885

“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.