SCHEMBL2458092

SCHEMBL2458092

Cc1cc(F)c(Nc2cccc(C#N)c2C#N)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
DHODH Q02127 1/20 0.34
CXCR2 P25025 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
KDM4E B2RXH2 2/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
EGFR P00533 2/20 0.32
RAPGEF4 Q8WZA2 1/20 0.32
LRRK2 Q5S007 2/20 0.32
TP53 P04637 1/20 0.32
CASP3 P42574 1/20 0.32
CASP7 P55210 1/20 0.32
ERBB2 P04626 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
GFER P55789 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
SCHEMBL27622785 0.77 EGFR (0.35) TSHRTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL2458086 0.77 EGFR (0.33) TSHRTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL2453586 0.74 LMNA (0.35) TSHRCXCR2TAS1R3TAS1R1TAS1R2
SCHEMBL2460758 0.71 TYK2 (0.38) KDM4ELRRK2CASP3CASP7ALDH1A1
SCHEMBL2455089 0.69 RAPGEF4 (0.49) TSHRKDM4EHSD17B10MEN1KMT2A
SCHEMBL7870059 0.68 MEN1 (0.50) TSHRKDM4EHSD17B10MEN1KMT2A
SCHEMBL6055529 0.68 KDM4E (0.49) DHODHCXCR2TAS1R3TAS1R1TAS1R2
SCHEMBL2394925 0.67 TSHR (0.40) TSHRCXCR2KDM4EHSD17B10ALDH1A1
SCHEMBL3191466 0.67 TRPV4 (0.46) DHODHKDM4EHSD17B10MEN1KMT2A
SCHEMBL22853013 0.65 KDM4E (0.41) TSHRTAS1R3TAS1R1TAS1R2KDM4E

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
EP-1577350-B1 Method for production of halogen-containing phthalocyanine compound NIPPON CATALYTIC CHEM IND (JP) 2011-09-14 EP disclosed
US-7473777-B2 Method for production of halogen-containing phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 2009-01-06 US disclosed
EP-1577350-A1 Method for production of halogen-containing phthalocyanine compound Nippon Shokubai Co., Ltd. (JP) 2005-09-21 EP disclosed
US-20050203293-A1 Method for production of halogen-containing phthalocyanine compound NIPPON SHOKUBAI CO., LTD. (JP) 2005-09-15 US disclosed