SCHEMBL21496248

SCHEMBL21496248

CCCCCCCCn1c(=O)c(-c2cccs2)cc2c1cc(-c1cccs1)c(=O)n2CCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.49
▸ KDM4E B2RXH2 6/20 0.49
▸ GAA P10253 1/20 0.49
▸ RXFP1 Q9HBX9 2/20 0.43
▸ BTK Q06187 1/20 0.43
▸ TSHR P16473 3/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ MAPT P10636 1/20 0.41
▸ RORA P35398 4/20 0.41
▸ RORC P51449 4/20 0.41
▸ RORB Q92753 4/20 0.41
▸ PGR P06401 4/20 0.40
▸ HPGD P15428 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40

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
SCHEMBL21501954 0.91 KDM4E (0.45) ALDH1A1KDM4EGAARXFP1BTK
SCHEMBL19240152 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EGAARXFP1BTK
SCHEMBL30659839 0.79 ALDH1A1 (0.47) ALDH1A1KDM4EGAARXFP1TSHR
SCHEMBL21496328 0.78 ALDH1A1 (0.43) ALDH1A1KDM4EGAABTKTSHR
SCHEMBL21993649 0.77 KDM4E (0.39) ALDH1A1KDM4EGAATSHRHSD17B10
SCHEMBL21501987 0.77 KDM4E (0.38) ALDH1A1KDM4ETSHRHSD17B10ALOX15
SCHEMBL21496247 0.77 KDM4E (0.58) ALDH1A1KDM4EMAPTRORARORC
SCHEMBL15277856 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EGAARXFP1TSHR
SCHEMBL16155983 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EGAARXFP1TSHR
SCHEMBL21502021 0.75 HTT (0.45) ALDH1A1KDM4ETSHRHSD17B10ALOX15

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 6 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
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 1597/4885KDM4E 2365/4885GAA 2593/4885
US-12104104-B2 Phosphor monomolecular compound, organic transistor using same, and water decomposition and hydrogen production photocatalytic system using same INPP5D, ATIC, INPP5B ALDH1A1 1840/4885KDM4E 2381/4885GAA 2595/4885

“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.

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