SCHEMBL13264352

SCHEMBL13264352

COc1ccc2cc(C)c(=O)n(CC3OCCO3)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.41
CCR2 P41597 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MTNR1A P48039 3/20 0.40
MTNR1B P49286 3/20 0.40
TP53 P04637 2/20 0.39
CCR9 P51686 1/20 0.39
EGFR P00533 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 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
SCHEMBL2797819 0.85 ERN1 (0.42) MAPTCCR2SMN1; SMN2NPSR1RXFP1
SCHEMBL2797570 0.84 MTNR1A (0.45) MAPTCCR2MTNR1AMTNR1BKDM4E
SCHEMBL2800061 0.84 MAPT (0.46) MAPTCCR2SMN1; SMN2NPSR1RXFP1
SCHEMBL2796615 0.81 HPGD (0.53) MAPTSMN1; SMN2NPSR1TP53EGFR
SCHEMBL2799788 0.81 KMT2A (0.44) MAPTCCR2SMN1; SMN2MTNR1AMTNR1B
SCHEMBL2793574 0.80 RXFP1 (0.41) SMN1; SMN2RXFP1TP53KDM4EALDH1A1
SCHEMBL2853393 0.79 TSHR (0.50) TP53KDM4EALDH1A1GAAHPGD
SCHEMBL4305180 0.77 MAPT (0.51) MAPTCCR2TP53CCR9
SCHEMBL13924451 0.76 BRD4 (0.45) MAPTCCR2SMN1; SMN2NPSR1RXFP1
SCHEMBL2793707 0.73 KCNH2 (0.48) NPSR1KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8329694-B2 Quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 US disclosed
US-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2010-07-01 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-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF ROS1, NOX1, ARG1 MAPT 4858/4885CCR2 433/4885SMN1; SMN2 1206/4885

“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.