SCHEMBL16426558

SCHEMBL16426558

CCCCCCCCCCOc1ccccc1C#Cc1ccc(C#Cc2ccccc2OCCCCCCCCCC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
NR1I2 O75469 1/20 0.48
LMNA P02545 1/20 0.48
CHRM2 P08172 1/20 0.48
CYP3A4 P08684 1/20 0.48
ADRA2A P08913 1/20 0.48
MAPT P10636 1/20 0.48
OPRK1 P41145 1/20 0.48
HTR2B P41595 1/20 0.48
SLC6A3 Q01959 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
MCHR1 Q99705 2/20 0.44
TLR8 Q9NR97 2/20 0.44
LTA4H P09960 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43

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
SCHEMBL16426721 0.95 CYP1A2 (0.45) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL27949421 0.85 L3MBTL1 (0.38) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL28323651 0.84 CYP1A2 (0.49) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL12431348 0.83 LTA4H (0.46) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL6884008 0.83 LTA4H (0.46) MEN1KMT2ANR1I2LMNACHRM2
SCHEMBL3469016 0.80 MEN1 (0.50) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL4461566 0.80 MEN1 (0.50) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL6958088 0.80 ALDH1A1 (0.58) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL15541094 0.80 ALDH1A1 (0.58) CYP1A2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL2121850 0.80 LMNA (0.54) CYP1A2CYP2C9CYP2C19MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9520564-B2 Photoelectric conversion material, method for producing the same, and organic photovoltaic cell containing the same HONDA MOTOR CO., LTD. (JP) 2016-12-13 US disclosed
US-9263688-B2 Photoelectric conversion material, method for producing the same, and organic photovoltaic cell containing the same HONDA MOTOR CO., LTD. (JP) 2016-02-16 US disclosed
US-9145468-B2 Photoelectric conversion material, method for producing the same, and organic photovoltaic cell containing the same HONDA MOTOR CO., LTD. (JP) 2015-09-29 US disclosed
US-20150059854-A1 PHOTOELECTRIC CONVERSION MATERIAL, METHOD FOR PRODUCING THE SAME, AND ORGANIC PHOTOVOLTAIC CELL CONTAINING THE SAME HONDA MOTOR CO., LTD. (JP) 2015-03-05 US disclosed
US-20150034880-A1 Photoelectric Conversion Material, Method For Producing The Same, And Organic Photovoltaic Cell Containing The Same HONDA MOTOR CO., LTD. (JP) 2015-02-05 US disclosed
US-20150038666-A1 Photoelectric Conversion Material, Method For Producing The Same, And Organic Photovoltaic Cell Containing The Same HONDA MOTOR CO., LTD. (JP) 2015-02-05 US disclosed