SCHEMBL9906184

SCHEMBL9906184

CC(C)C(NP(=O)(c1ccccc1)c1ccccc1)C(=O)Nc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 3/20 0.53
RXFP1 Q9HBX9 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.50
HPGD P15428 3/20 0.48
LMNA P02545 2/20 0.48
GAA P10253 2/20 0.48
HDAC8 Q9BY41 4/20 0.47
HDAC6 Q9UBN7 4/20 0.47
HTT P42858 2/20 0.46
RAB9A P51151 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
HDAC3 O15379 3/20 0.46
HDAC4 P56524 3/20 0.46
HDAC1 Q13547 3/20 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
SCHEMBL9906188 0.82 SMN1; SMN2 (0.46) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL12310908 0.78 MAPT (0.56) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL9906190 0.78 TSHR (0.47) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL27138709 0.77 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMAPTRXFP1
Hydrochloric Acid SCHEMBL27138478 0.77 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL12640496 0.77 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL13645665 0.76 SMN1; SMN2 (0.57) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL11991380 0.74 ALDH1A1 (0.51) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL21731603 0.73 SMN1; SMN2 (0.55) ALDH1A1MEN1KMT2AMAPTRXFP1
SCHEMBL9906183 0.72 CYP3A4 (0.45) ALDH1A1MEN1KMT2AMAPTSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198445-B2 Phosphoramide compound, method for producing the same, ligand, complex, catalyst and method for producing optically active alcohol NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2012-06-12 US disclosed
US-20100113786-A1 PHOSPHORAMIDE COMPOUND, METHOD FOR PRODUCING THE SAME, LIGAND, COMPLEX, CATALYST AND METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2010-05-06 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-20100113786-A1 PHOSPHORAMIDE COMPOUND, METHOD FOR PRODUCING THE SAME, LIGAND, COMPLEX, CATALYST AND METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL ADH1C, ADH1A, DERA ALDH1A1 424/4885MEN1 1119/4885KMT2A 501/4885

“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.