SCHEMBL18845154

SCHEMBL18845154

C/C=C/c1ccc(N=[N+]=[N-])cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA5B Q9Y2D0 1/20 0.41
▸ PTGS2 P35354 4/20 0.37
▸ RAD51 Q06609 1/20 0.37
▸ CYP51A1 Q16850 2/20 0.36
▸ NOX1 Q9Y5S8 2/20 0.36
▸ CNR2 P34972 1/20 0.35
▸ PSMB8 P28062 1/20 0.33
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 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
SCHEMBL14071504 1.00 TP53 (0.42) TP53CYP3A4LMNATSHRKDM4E
SCHEMBL13668357 1.00 TP53 (0.42) TP53CYP3A4LMNATSHRKDM4E
SCHEMBL23854165 0.87 CA1 (0.47) TP53CA1CA2CA5ACA9
SCHEMBL13882617 0.87 CA1 (0.47) TP53CA1CA2CA5ACA9
SCHEMBL27738663 0.79 CA1 (0.41) TP53CA1CA2CA5ACA9
SCHEMBL27742228 0.79 CA1 (0.41) TP53CA1CA2CA5ACA9
SCHEMBL27738661 0.79 CA1 (0.41) TP53CA1CA2CA5ACA9
SCHEMBL18845153 0.79 CA1 (0.41) TP53CA1CA2CA5ACA9
SCHEMBL27786875 0.79 PTGS2 (0.41) TP53CA1CA2CA5ACA9
SCHEMBL18130122 0.78 NQO2 (0.48) TP53CYP3A4LMNAKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110383538-A Thin film electrode, resin layer forming ink, inorganic layer forming ink, and electrode printing apparatus 株式会社理光 2019-10-25 — — CN disclosed
WO-2017078623-A1 BACKGROUND-FREE FLUORESCENT PROBES FOR LIVE CELL IMAGING NATIONAL UNIVERSITY OF SINGAPORE (SG) 2017-05-11 — — WO disclosed
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