SCHEMBL21501985

SCHEMBL21501985

COCCOCCOCCn1c(=O)ccc2c1ccc(=O)n2CCOCCOCCOC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
POLB P06746 1/20 0.39
MAPK1 P28482 1/20 0.39
MGLL Q99685 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CNR1 P21554 3/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
CCND2 P30279 1/20 0.36

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
SCHEMBL14982730 0.75 KDM4E (0.58) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL13387568 0.71 MEN1 (0.70) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL30294930 0.71 MEN1 (0.70) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL14578721 0.71 MEN1 (0.70) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL30716978 0.71 MEN1 (0.70) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL21501927 0.71 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL25985621 0.70 SIGMAR1 (0.47) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL17453133 0.69 PTGER4 (0.44) ALDH1A1SMN1; SMN2RAB9AKDM4ENPC1
SCHEMBL9917644 0.68 MGLL (0.80) ALDH1A1SMN1; SMN2RAB9APKMMAPK1
SCHEMBL1970948 0.68 MGLL (0.80) ALDH1A1SMN1; SMN2RAB9APKMMAPK1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240409809-A1 PHOSPHOR MONOMOLECULAR COMPOUND, ORGANIC TRANSISTOR USING SAME, AND WATER DECOMPOSITION AND HYDROGEN PRODUCTION PHOTOCATALYTIC SYSTEM USING SAME SEOUL NAT UNIV R&DB FOUNDATION (KR) 2024-12-12 US disclosed
US-12104104-B2 Phosphor monomolecular compound, organic transistor using same, and water decomposition and hydrogen production photocatalytic system using same SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2024-10-01 US disclosed
US-20210179933-A1 PHOSPHOR MONOMOLECULAR COMPOUND, ORGANIC TRANSISTOR USING SAME, AND WATER DECOMPOSITION AND HYDROGEN PRODUCTION PHOTOCATALYTIC SYSTEM USING SAME SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2021-06-17 US disclosed
US-20210179933-A1 PHOSPHOR MONOMOLECULAR COMPOUND, ORGANIC TRANSISTOR USING SAME, AND WATER DECOMPOSITION AND HYDROGEN PRODUCTION PHOTOCATALYTIC SYSTEM USING SAME SEOUL NATIONAL UNIVERSITY R&DB FOUNDATION (KR) 2021-06-17 US disclosed
WO-2019203481-A1 PHOSPHOR MONOMOLECULAR COMPOUND, ORGANIC TRANSISTOR USING SAME, AND WATER DECOMPOSITION AND HYDROGEN PRODUCTION PHOTOCATALYTIC SYSTEM USING SAME 서울대학교 산학협력단 2019-10-24 WO 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 (2 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-20240409809-A1 PHOSPHOR MONOMOLECULAR COMPOUND, ORGANIC TRANSISTOR USING SAME, AND WATER DECOMPOSITION AND HYDROGEN PRODUCTION PHOTOCATALYTIC SYSTEM USING SAME INPP5D, INPP5B, PPA1 ALDH1A1 1597/4885SMN1; SMN2 4481/4885RAB9A 1839/4885
US-12104104-B2 Phosphor monomolecular compound, organic transistor using same, and water decomposition and hydrogen production photocatalytic system using same INPP5D, ATIC, INPP5B ALDH1A1 1840/4885SMN1; SMN2 4636/4885RAB9A 2568/4885

“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.