SCHEMBL17384186

SCHEMBL17384186

O=P(O)(O)CC[n+]1ccc(-c2cc[n+](Cc3cc(C[n+]4ccc(-c5cc[n+](Cc6ccccc6)cc5)cc4)cc(C[n+]4ccc(-c5cc[n+](Cc6ccccc6)cc5)cc4)c3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ CHKA P35790 9/20 0.41
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ KMT2A Q03164 1/20 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
SCHEMBL13851328 0.95 ALDH1A1 (0.53) ALDH1A1KDM4ERAB9ACHKALMNA
Bromide SCHEMBL3361424 0.94 ALDH1A1 (0.51) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL19757277 0.82 MMP2 (0.34) ALDH1A1KDM4ERAB9A
SCHEMBL1226951 0.80 MEN1 (0.39) ALDH1A1KDM4ERAB9ALMNASMN1; SMN2
Hydrochloric Acid SCHEMBL193019 0.80 BCHE (0.40) ALDH1A1KDM4ERAB9AMEN1KMT2A
Hydrochloric Acid SCHEMBL602361 0.79 S1PR2 (0.48) ALDH1A1KDM4ERAB9A
Hydrochloric Acid SCHEMBL210855 0.79 MEN1 (0.38) ALDH1A1KDM4ERAB9ALMNASMN1; SMN2
Bromide SCHEMBL918125 0.79 MEN1 (0.38) ALDH1A1KDM4ERAB9ACHKALMNA
SCHEMBL13851324 0.77 CHKA (0.58) ALDH1A1CHKALMNASMN1; SMN2HTT
Benzyl Viologen SCHEMBL1108041 0.77 ALDH1A1 (0.74) ALDH1A1KDM4ERAB9ACHKALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015193301-A1 AN ELECTROCHROMIC MATERIAL, AND AN ELECTROCHROMIC PARTICLE AND AN ELECTROCHROMIC DEVICE COMPRISING THE SAME IRIDOS LTD. (KR) 2015-12-23 — — WO disclosed
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