SCHEMBL17419217

SCHEMBL17419217

CCCCCCCCCCC1=C2C=CC(=N2)C=C2C=CC(=N2)C(CCCCCCCCCC)=C2C=CC(=N2)C=C2C=CC1=N2

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 9/20 0.31
▸ MPEG1 Q2M385 7/20 0.31
▸ XIAP P98170 2/20 0.31
▸ GPR84 Q9NQS5 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ PTGES O14684 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KAT2B Q92831 1/20 0.31

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
SCHEMBL6003914 0.99 ALOX5 (0.31) ALOX5MPEG1XIAPGPR84KDM4E
Hydrochloric Acid SCHEMBL27872843 0.97 ALOX5 (0.30) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL1772836 0.92 ALOX5 (0.30) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL585686 0.85 PTGS2 (0.35) GPR84
SCHEMBL17419221 0.85 — —
SCHEMBL7262706 0.83 TLR8 (0.32) KDM4EMEN1USP2ALDH1A1MAPT
SCHEMBL7717025 0.83 — —
SCHEMBL7161176 0.82 — —
SCHEMBL434101 0.82 KCNH2 (0.38) ALOX5MPEG1XIAPGPR84KDM4E
SCHEMBL1194296 0.81 KCNH2 (0.35) ALOX5MPEG1XIAPGPR84KDM4E

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
CN-105315699-B Zinc purple photosensitive dye and photoelectric conversion device thereof 财团法人工业技术研究院 2018-04-13 — — CN disclosed
US-9546278-B2 Porphyrin photosensitive dye and photoelectric conversion device utilizing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-01-17 — — US disclosed
CN-105315699-A Zinc purple photosensitive dye and photoelectric conversion device thereof IND TECH RES INST 2016-02-10 — — CN disclosed
US-20160009921-A1 PORPHYRIN PHOTOSENSITIVE DYE AND PHOTOELECTRIC CONVERSION DEVICE UTILIZING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2016-01-14 — — US disclosed
Send feedback