SCHEMBL27583119

SCHEMBL27583119

Cc1ccccc1Cc1ccccc1.O=[N+]([O-])c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 4/20 0.51
▸ CYP2C19 P33261 4/20 0.51
▸ MAPT P10636 5/20 0.51
▸ ALDH1A1 P00352 5/20 0.51
▸ MEN1 O00255 4/20 0.51
▸ KMT2A Q03164 4/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ CRHBP P24387 4/20 0.50
▸ CRHR2 Q13324 4/20 0.50
▸ CYP3A4 P08684 3/20 0.50
▸ CYP2D6 P10635 3/20 0.50
▸ CYP2C9 P11712 3/20 0.50
▸ LMNA P02545 1/20 0.50
▸ ACHE P22303 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ HTT P42858 2/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ RIPK1 Q13546 1/20 0.47
▸ PTPRF P10586 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
SCHEMBL10544797 0.95 POLB (0.51) CYP1A2CYP2C19MAPTALDH1A1MEN1
Dinitrophenylene SCHEMBL27738927 0.89 TSHR (0.53) CYP1A2CYP2C19MAPTALDH1A1MEN1
SCHEMBL10340535 0.87 CYP3A4 (0.55) CYP1A2CYP2C19MAPTALDH1A1MEN1
SCHEMBL27672997 0.86 HSD17B10 (0.58) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL267666 0.81 ALDH1A1 (0.70) CYP1A2CYP2C19MAPTALDH1A1MEN1
SCHEMBL29940610 0.81 CALM1 (0.55) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL275838 0.81 CALM1 (0.55) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL9741301 0.81 CALM1 (0.55) CYP1A2CYP2C19ALDH1A1MEN1KMT2A
SCHEMBL11206721 0.81 POLB (0.51) CYP1A2CYP2C19MAPTALDH1A1MEN1
SCHEMBL10918768 0.79 ALDH1A1 (0.56) CYP1A2CYP2C19MAPTALDH1A1MEN1

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-1480493-B Mimeograph ink for correcting tiny coloured pattern defect, colour filter, correction method for such defect and manufacturing process for mimeographo ink DAINIPPON PRINTING CO LTD 2010-05-12 — — CN disclosed
CN-1480493-A Mimeograph ink for correcting tiny coloured pattern defect colour filter, correction method for such defect and mfg. process for mimeographo ink 大日本印刷株式会社 2004-03-10 — — CN disclosed
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