SCHEMBL9909435

SCHEMBL9909435

CN(C)c1ccc(C(=N)NCl)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P4HTM Q9NXG6 2/20 0.38
NPC1 O15118 6/20 0.37
ALDH1A1 P00352 5/20 0.37
MAPT P10636 4/20 0.37
RAB9A P51151 4/20 0.37
MAPK1 P28482 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
GAA P10253 2/20 0.37
MCL1 Q07820 2/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
RECQL P46063 1/20 0.37
ALOX15 P16050 2/20 0.36
TSHR P16473 2/20 0.36
CYP3A4 P08684 1/20 0.36
HBB P68871 1/20 0.36
KDM4E B2RXH2 3/20 0.36
KCNH2 Q12809 2/20 0.34
PKM P14618 2/20 0.34

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
SCHEMBL9909446 0.77 CCR1 (0.40) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL9109279 0.77 PRMT1 (0.41) P4HTMALDH1A1MAPTMAPK1L3MBTL1
SCHEMBL9909447 0.75 KDM4E (0.56) NPC1ALDH1A1MAPTRAB9AMAPK1
SCHEMBL978302 0.71 P4HTM (0.60) P4HTMNPC1ALDH1A1MAPTMAPK1
SCHEMBL7082772 0.71 P4HTM (0.45) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL10473068 0.70 MAPK1 (0.61) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL4303236 0.69 ALDH1A1 (0.43) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL28247848 0.69 KMT2A (0.49) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL19387743 0.68 KCNH2 (0.39) P4HTMNPC1ALDH1A1MAPTRAB9A
SCHEMBL15627393 0.65 KDM4E (0.41) NPC1ALDH1A1MAPTRAB9AMAPK1

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-9150601-B2 Blue-light-emitting iridium complex, iridium complex monomer, phosphorus polymer, and organic electroluminescence device using same GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-10-06 US disclosed
US-20120138917-A1 BLUE-LIGHT-EMITTING IRIDIUM COMPLEX, IRIDIUM COMPLEX MONOMER, PHOSPHORUS POLYMER, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME GWANGJU INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2012-06-07 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-20120138917-A1 BLUE-LIGHT-EMITTING IRIDIUM COMPLEX, IRIDIUM COMPLEX MONOMER, PHOSPHORUS POLYMER, AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME IPMK, INTS9, ITK P4HTM 3325/4885NPC1 4880/4885ALDH1A1 1529/4885

“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.