SCHEMBL6013668

SCHEMBL6013668

Cc1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1NF

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.54
NR3C1 P04150 5/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
TSHR P16473 1/20 0.43
NR1H2 P55055 2/20 0.42
NR1H3 Q13133 2/20 0.42
S1PR1 P21453 2/20 0.41
PTPN1 P18031 1/20 0.40
CNR2 P34972 2/20 0.40
SLC16A3 O15427 1/20 0.38
SLC16A1 P53985 1/20 0.38
QPCT Q16769 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
AR P10275 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38

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
SCHEMBL10990507 0.84 CYP2C19 (0.47) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL6858562 0.78 S100B (0.52) CYP2C19TSHRS1PR1
SCHEMBL28079852 0.77 CYP2C19 (0.58) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL11210639 0.76 CYP2C19 (0.49) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL18298063 0.74 CYP2C19 (0.54) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL19827216 0.74 CYP2C19 (0.50) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL10781342 0.73 CYP2C19 (0.58) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL10787489 0.73 CYP2C19 (0.53) CYP2C19NR3C1CRHBPCRHR2TSHR
SCHEMBL1262833 0.72 ALDH1A1 (0.38) NR1H2NR1H3CNR2SLC16A3SLC16A1
SCHEMBL2960872 0.72 CYP2C19 (0.78) CYP2C19NR3C1CRHBPCRHR2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1717152-A2 Thermosensitive adhesive label Ricoh Company, Ltd. (JP) 2006-11-02 EP disclosed
EP-1052177-B1 Heat activating and thermosensitive recording for thermosensitive adhesive label RICOH KK (JP) 2006-08-02 EP disclosed
US-6731319-B2 Heat activating and thermosensitive recording for thermosensitive adhesive label RICOH COMPANY, LTD. (JP) 2004-05-04 US disclosed
US-6501495-B1 Heat activating and thermosensitive recording for thermosensitive adhesive label RICOH COMPANY, LTD. (JP) 2002-12-31 US disclosed
EP-1052177-A1 Heat activating and thermosensitive recording for thermosensitive adhesive label Ricoh Company, Ltd. (JP) 2000-11-15 EP disclosed