SCHEMBL23453256

SCHEMBL23453256

CNCCCNC(=O)C1=C/C=C\C=C/C=C\1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TP53 P04637 1/20 0.32
▸ NAAA Q02083 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32

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
SCHEMBL23453250 0.95 TSHR (0.38) TSHRHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL23453254 0.90 HDAC4 (0.33) TSHRHPGD
SCHEMBL23419447 0.84 ALDH1A1 (0.35) TSHRHPGDALDH1A1KDM4EMAPT
SCHEMBL26050489 0.83 TP53BP1 (0.48) TSHRALDH1A1KDM4EMAPTTHRB
SCHEMBL23392478 0.81 KDM4E (0.39) TSHRKDM4E
SCHEMBL23419457 0.81 KDM4E (0.39) TSHRKDM4E
SCHEMBL26385379 0.80 NAAA (0.36) TSHRHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL23392477 0.79 PAOX (0.44) ALDH1A1SMN1; SMN2
SCHEMBL23419305 0.79 PAOX (0.44) ALDH1A1SMN1; SMN2
SCHEMBL23419522 0.78 TP53BP1 (0.44) TSHRALDH1A1KDM4EMAPTSMN1; SMN2

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
WO-2024003087-A1 FLUORESCENT DYES CONTAINING FUSED TETRACYCLIC BIS-BORON HETEROCYCLE AND USES IN SEQUENCING ILLUMINA, INC. (US) 2024-01-04 — — WO disclosed
WO-2023186819-A1 CHROMENOQUINOLINE DYES AND USES IN SEQUENCING ILLUMINA CAMBRIDGE LIMITED (GB) 2023-10-05 — — WO disclosed
WO-2022136402-A1 METHODS AND COMPOSITIONS FOR NUCLEIC ACID SEQUENCING ILLUMINA CAMBRIDGE LIMITED (GB) 2022-06-30 — — WO disclosed
WO-2022129437-A1 LONG STOKES SHIFT CHROMENOQUINOLINE DYES AND USES IN SEQUENCING APPLICATIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2022-06-23 — — WO disclosed
WO-2022129930-A1 ALKYLPYRIDINIUM COUMARIN DYES AND USES IN SEQUENCING APPLICATIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2022-06-23 — — WO disclosed
WO-2021104845-A1 CYCLOOCTATETRAENE CONTAINING DYES AND COMPOSITIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2021-06-03 — — WO disclosed
Send feedback