SCHEMBL7114512

SCHEMBL7114512

CCCc1ccc(Cc2ccccc2)c(C)c1C

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.46
HTR2A P28223 1/20 0.42
CALM1 P0DP23 1/20 0.42
BCL2 P10415 1/20 0.41
BCL2L1 Q07817 1/20 0.41
CTRC Q99895 3/20 0.41
LDHA P00338 1/20 0.40
LDHB P07195 1/20 0.40
TP53 P04637 1/20 0.39
CNR2 P34972 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39

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
SCHEMBL8098213 0.87 CALM1 (0.55) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL8005691 0.83 TP53 (0.48) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL5249364 0.81 HTR2A (0.63) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL6546504 0.79 TLR8 (0.44) HTR2ACALM1CNR2GPR55
SCHEMBL8932351 0.79 POLB (0.47) ALOX5CALM1BCL2BCL2L1CTRC
SCHEMBL7990271 0.79 CALM1 (0.46) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL8102347 0.78 HTR2A (0.59) HTR2ACALM1BCL2BCL2L1TP53
SCHEMBL8993130 0.78 CTRC (0.46) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL5250742 0.77 BCL2 (0.47) ALOX5HTR2ACALM1BCL2BCL2L1
SCHEMBL8095678 0.77 CALM1 (0.44) ALOX5HTR2ACALM1BCL2BCL2L1

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
EP-1297967-A2 Thermal recording material and production method thereof FUJI PHOTO FILM CO., LTD. (JP) 2003-04-02 EP disclosed
US-6127314-A HAVING HIGHLY TRANSPARENT HEAT-SENSITIVE LAYER COMPRISING COLORLESS ELECTRON DONATIVE DYE PRECURSOR INSIDE MICROCAPSULES; AND SOLID PARTICLES OF RELATIVELY LARGE DIAMETER IN A DISPERSION; AND HIGH COLOR FORMING SENSITIVITY FUJI PHOTO FILM CO., LTD. (JP) 2000-10-03 US disclosed