SCHEMBL9296086

SCHEMBL9296086

CCCCCCCCCCCCc1ccc(Nc2nc(Cl)nc(Cl)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 1/20 0.55
▸ AHR P35869 1/20 0.55
▸ STK17A Q9UEE5 3/20 0.54
▸ STK17B O94768 1/20 0.54
▸ NFKB1 P19838 3/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ POLA1 P09884 2/20 0.53
▸ MAPT P10636 3/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ CACNA1B Q00975 1/20 0.51
▸ APBA1 Q02410 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ UNG P13051 3/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ POLB P06746 1/20 0.48
▸ KCNH3 Q9ULD8 2/20 0.47
▸ TXN P10599 1/20 0.46

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
SCHEMBL9391146 0.94 POLA1 (0.59) NR1I2AHRSTK17ASTK17BNFKB1
SCHEMBL10851727 0.94 POLA1 (0.59) NR1I2AHRSTK17ASTK17BNFKB1
SCHEMBL1266331 0.91 STK17A (0.54) STK17ASTK17BKDM4EPOLA1UNG
SCHEMBL1264648 0.91 STK17A (0.54) STK17ASTK17BKDM4EPOLA1UNG
SCHEMBL11785913 0.83 NFKB1 (0.55) NR1I2AHRNFKB1KDM4EMAPT
SCHEMBL28788723 0.82 POLA1 (0.53) STK17ASTK17BPOLA1UNGKCNH3
SCHEMBL27817598 0.82 POLA1 (0.53) STK17ASTK17BPOLA1UNGKCNH3
SCHEMBL2416578 0.82 LMNA (0.50) STK17ASTK17BKDM4EPOLA1MAPT
Ammonia Solution, Strong SCHEMBL10608660 0.82 ESR1 (0.59) KDM4EMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL17268197 0.80 NFKB1 (0.63) NR1I2AHRSTK17ASTK17BNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4563189-A WOOL AND COTTON WOOL DEVELOPMENT INTERNATIONAL LTD. (GB) 1986-01-07 — — US claimed
EP-0582687-A4 PERMANENTLY STAIN RESISTANT TEXTILE FIBERS. PEACH STATE LABS INC (US) 1994-12-14 — — EP disclosed
EP-0582687-A1 PERMANENTLY STAIN RESISTANT TEXTILE FIBERS PEACH STATE LABS, INC. (US) 1994-02-16 — — EP disclosed
WO-1992018332-A1 PERMANENTLY STAIN RESISTANT TEXTILE FIBERS PEACH STATE LABS, INC. (US) 1992-10-29 — — WO disclosed
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