SCHEMBL17323601

SCHEMBL17323601

C[N+](C)(CCCNC(=O)c1c2ccccc2cc2ccccc12)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
TP53 P04637 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TAAR1 Q96RJ0 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
GLA P06280 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
FAAH O00519 1/20 0.39
OPRM1 P35372 2/20 0.39

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
SCHEMBL17323609 0.85 TSHR (0.46) MEN1KMT2AMAPK1SMN1; SMN2KDM4E
SCHEMBL17323592 0.84 ALDH1A1 (0.44) MEN1KMT2ATP53MAPK1KDM4E
SCHEMBL17323608 0.80 RAB9A (0.44) MEN1KMT2AMAPK1SMN1; SMN2KDM4E
SCHEMBL17323612 0.79 ALDH1A1 (0.46) MEN1KMT2ATP53MAPK1SMN1; SMN2
SCHEMBL20734832 0.78 ALDH1A1 (0.52) MEN1KMT2AKDM4EALDH1A1CYP1A2
SCHEMBL17323602 0.78 KDM4E (0.47) DNM1MEN1KMT2ATP53MAPK1
SCHEMBL17472220 0.77 DNM1 (0.53) DNM1MEN1KMT2ATP53MAPK1
SCHEMBL5113391 0.77 TSHR (0.58) MEN1KMT2AMAPK1SMN1; SMN2KDM4E
SCHEMBL11640078 0.75 TSHR (0.60) MEN1KMT2ATP53SMN1; SMN2KDM4E
SCHEMBL17323598 0.75 KDM4E (0.48) DNM1MEN1KMT2ATP53MAPK1

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-9490144-B2 Quaternary ammonium salt compound, composition for forming a resist under layer film, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-11-08 US disclosed
US-20150357204-A1 QUATERNARY AMMONIUM SALT COMPOUND, COMPOSITION FOR FORMING A RESIST UNDER LAYER FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-12-10 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-20150357204-A1 QUATERNARY AMMONIUM SALT COMPOUND, COMPOSITION FOR FORMING A RESIST UNDER LAYER FILM, AND PATTERNING PROCESS ASH2L, ARL1, ASH1L DNM1 1498/4885MEN1 2576/4885KMT2A 812/4885

“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.