SCHEMBL14707342

SCHEMBL14707342

CC(C)(C)c1ccc2c3c(cccc13)C(=O)N2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 1/20 0.57
CDK5R1 Q15078 1/20 0.57
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 8/20 0.53
HPGD P15428 6/20 0.53
HSD17B10 Q99714 5/20 0.53
CASP1 P29466 4/20 0.53
CASP7 P55210 4/20 0.53
HTT P42858 1/20 0.53
POLB P06746 4/20 0.51
USP2 O75604 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
KLK7 P49862 1/20 0.48
GAA P10253 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GLA P06280 1/20 0.48
ALPL P05186 1/20 0.47
TP53 P04637 2/20 0.46

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
SCHEMBL23563365 0.87 MEN1 (0.57) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL13256237 0.78 CDK5 (0.57) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL4024272 0.76 CDK5 (0.68) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL9450612 0.76 CDK5 (0.72) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL11174222 0.76 CDK5 (0.59) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL22549691 0.76 CDK5 (0.55) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL9078891 0.75 CDK5 (0.67) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL14712322 0.75 KDM4E (0.58) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL9450624 0.75 KDM4E (0.73) CDK5CDK5R1KDM4EALDH1A1HPGD
SCHEMBL9450643 0.75 CDK5 (0.55) CDK5CDK5R1KDM4EALDH1A1HPGD

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-20130045952-A1 ABA Receptor Agonists for Increased Plant Stress Resistance VAN ANDEL RESEARCH INSTITUTE (US) 2013-02-21 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-20130045952-A1 ABA Receptor Agonists for Increased Plant Stress Resistance BROX, AAK1, ADORA3 CDK5 2316/4885CDK5R1 1196/4885KDM4E 3079/4885

“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.