SCHEMBL29528699

SCHEMBL29528699

CN1c2ccccc2N(c2c(-c3ccccc3)c(N3c4ccccc4N(C)c4ccccc43)c(-c3ccc(-c4nc5ccccc5s4)cc3)c(N3c4ccccc4N(C)c4ccccc43)c2-c2ccccc2)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.50
APP P05067 6/20 0.50
NPC1 O15118 5/20 0.50
KDM4E B2RXH2 4/20 0.50
PKM P14618 3/20 0.50
GLA P06280 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
KMT2A Q03164 2/20 0.50
MMP9 P14780 2/20 0.50
MMP8 P22894 2/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.50
PAX8 Q06710 1/20 0.50
NOD2 Q9HC29 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TNF P01375 1/20 0.50
NOD1 Q9Y239 1/20 0.50

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
SCHEMBL29528661 0.97 RAB9A (0.48) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528648 0.97 RAB9A (0.48) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528409 0.97 RAB9A (0.48) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528750 0.90 ILK (0.44) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528740 0.88 KDM4E (0.49) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29529518 0.88 ILK (0.46) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528682 0.86 ILK (0.43) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29529018 0.86 RAB9A (0.49) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528870 0.86 ILK (0.43) RAB9AAPPNPC1KDM4EPKM
SCHEMBL29528518 0.85 RAB9A (0.48) RAB9AAPPNPC1KDM4EPKM

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-11283027-B1 Composition of matter for use in organic light-emitting diodes KYULUX, INC. (JP) 2022-03-22 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-11283027-B1 Composition of matter for use in organic light-emitting diodes ALDH1A2, CYBA, CRY2 RAB9A 3307/4885APP 1332/4885NPC1 863/4885

“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.