SCHEMBL5778701

SCHEMBL5778701

NNc1ccc(-c2cn3cccnc3n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.71
KMT2A Q03164 4/20 0.71
ALDH1A1 P00352 12/20 0.68
KDM4E B2RXH2 11/20 0.68
HPGD P15428 6/20 0.68
GLA P06280 6/20 0.68
HSD17B10 Q99714 4/20 0.68
NPC1 O15118 9/20 0.67
GAA P10253 8/20 0.67
SMN1; SMN2 Q16637 5/20 0.67
MAPT P10636 4/20 0.67
MEN1 O00255 3/20 0.67
TP53 P04637 3/20 0.67
CYP1A2 P05177 2/20 0.66
POLB P06746 2/20 0.62
GFER P55789 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58

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
SCHEMBL17750396 0.84 ALDH1A1 (0.75) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL1494735 0.83 RAB9A (1.00) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL17750400 0.82 KDM4E (0.84) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL17750391 0.82 RAB9A (0.84) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL5305847 0.81 ALDH1A1 (0.76) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL3671367 0.81 ALDH1A1 (1.00) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL971743 0.80 ALDH1A1 (1.00) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL1692157 0.80 ALDH1A1 (1.00) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL14646388 0.80 ALDH1A1 (0.73) RAB9AKMT2AALDH1A1KDM4EHPGD
SCHEMBL12970202 0.80 ALDH1A1 (0.73) RAB9AKMT2AALDH1A1KDM4EHPGD

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-20060276433-A1 Hydrazone derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-12-07 US disclosed
EP-1612204-A1 HYDRAZONE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-01-04 EP 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-20060276433-A1 Hydrazone derivative APP, PRNP, HTT RAB9A 3127/4885KMT2A 3533/4885ALDH1A1 1541/4885

“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.