SCHEMBL26413612

SCHEMBL26413612

O=C(Cc1ccccc1[N+](=O)[O-])OC1(c2ccccc2)CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
KMT2A Q03164 5/20 0.42
MEN1 O00255 4/20 0.42
MAPT P10636 1/20 0.42
LMNA P02545 1/20 0.40
APP P05067 1/20 0.40
GLA P06280 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 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
SCHEMBL24944105 0.90 ALDH1A1 (0.38) ALDH1A1L3MBTL1KMT2AMEN1LMNA
SCHEMBL26413523 0.88 CYP1A2 (0.51) ALDH1A1L3MBTL1KMT2AMAPTCYP3A4
SCHEMBL26478782 0.87 KMT2A (0.40) ALDH1A1L3MBTL1NPC1RAB9AKMT2A
SCHEMBL26413601 0.82 ALDH1A1 (0.51) ALDH1A1L3MBTL1NPC1RAB9AKMT2A
SCHEMBL24944882 0.82 AKR1B1 (0.45) ALDH1A1L3MBTL1KMT2AMEN1MAPT
SCHEMBL26413609 0.81 ALDH1A1 (0.48) ALDH1A1L3MBTL1RAB9AKMT2AMEN1
SCHEMBL26413516 0.81 MEN1 (0.43) ALDH1A1KMT2AMEN1MAPTLMNA
SCHEMBL26413712 0.81 L3MBTL1 (0.39) ALDH1A1L3MBTL1NPC1RAB9AKMT2A
SCHEMBL24944664 0.81 OPRM1 (0.47) ALDH1A1KMT2AMEN1LMNA
SCHEMBL24943645 0.81 OPRM1 (0.41) SMN1; SMN2CYP2D6

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-11644753-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-09 US disclosed
US-20230131303-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-04-27 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-11644753-B2 Resist composition and patterning process HNRNPU, NSUN2, HNRNPR ALDH1A1 4767/4885L3MBTL1 2012/4885NPC1 4818/4885

“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.