SCHEMBL14848539

SCHEMBL14848539

N#[N+]c1ccc(Oc2ccc([N+]#N)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ LTA4H P09960 4/20 0.38
▸ MAOA P21397 2/20 0.35
▸ NR1H2 P55055 1/20 0.35
▸ BAX Q07812 1/20 0.35
▸ MAPT P10636 4/20 0.33
▸ PARP15 Q460N3 1/20 0.33
▸ PARP14 Q460N5 1/20 0.33
▸ PARP10 Q53GL7 1/20 0.33
▸ PARP16 Q8N5Y8 1/20 0.33
▸ PARP11 Q9NR21 1/20 0.33
▸ PARP4 Q9UKK3 1/20 0.33
▸ TEAD4 Q15561 1/20 0.33

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
SCHEMBL6291052 0.90 LTA4H (0.57) KMT2ATSHRMEN1LTA4HMAOA
Hydrochloric Acid SCHEMBL3796451 0.88 LTA4H (0.55) KMT2ATSHRMEN1LTA4HMAOA
SCHEMBL31448055 0.88 SOS1 (0.44) ALDH1A1KMT2ATSHRTDP1MEN1
SCHEMBL31448011 0.88 TEAD4 (0.52) ALDH1A1KMT2ATSHRTDP1MEN1
SCHEMBL31447998 0.82 SMN1; SMN2 (0.39) ALDH1A1LTA4HMAPTHPGDRAB9A
SCHEMBL31447981 0.82 MAOA (0.38) ALDH1A1KMT2ATSHRMEN1MAOA
SCHEMBL31447963 0.82 ALDH1A1 (0.59) ALDH1A1KMT2ATSHRTDP1MEN1
SCHEMBL28476939 0.82 LTA4H (0.48) KMT2ATSHRMEN1LTA4HMAOA
Hydrochloric Acid SCHEMBL11464569 0.81 CYP1A1 (0.39) ALDH1A1TSHRMAOBGAA
SCHEMBL31448112 0.81 KMT2A (0.47) ALDH1A1KMT2ATDP1MEN1MAPT

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
US-20130089703-A1 SOLDER RESIST COMPOSITION, BOARD FOR PACKAGE COMPRISING SOLDER RESIST OPENING USING THE COMPOSITION, AND METHOD FOR PREPARING THE BOARD FOR PACKAGE SUNGKYUNKWAN UNIVERSITY FOUNDATION FOR CORPORATE COLLABORATION (KR) 2013-04-11 — — US disclosed
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