SCHEMBL5058608

SCHEMBL5058608

C=CCCC=CC=C(C)CCC(=C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.41
TUBB4A P04350 12/20 0.34
TUBB P07437 12/20 0.34
TUBA3C P0DPH7 12/20 0.34
TUBA1B P68363 12/20 0.34
TUBA4A P68366 12/20 0.34
TUBB4B P68371 12/20 0.34
TUBB3 Q13509 12/20 0.34
TUBB2A Q13885 12/20 0.34
TUBB8 Q3ZCM7 12/20 0.34
TUBA3E Q6PEY2 12/20 0.34
TUBA1A Q71U36 12/20 0.34
TUBA1C Q9BQE3 12/20 0.34
TUBB6 Q9BUF5 12/20 0.34
TUBB2B Q9BVA1 12/20 0.34
TUBB1 Q9H4B7 12/20 0.34
NR1I2 O75469 1/20 0.31
LMNA P02545 1/20 0.31
PGR P06401 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
SCHEMBL11834059 0.74 CNR1 (0.34) CNR1
SCHEMBL28705494 0.74 TSHR (0.33) LMNA
SCHEMBL11834055 0.74 CNR1 (0.34) CNR1
SCHEMBL30777265 0.72 TSHR (0.32)
SCHEMBL27727213 0.71 HSD17B10 (0.32) NR1I2LMNAPGR
SCHEMBL42883 0.69
SCHEMBL5872297 0.66 TSHR (0.38)
SCHEMBL11267547 0.66
SCHEMBL11653315 0.66 ALDH1A1 (0.52)
SCHEMBL11653310 0.66 ALDH1A1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1841823-B1 CONDUCTIVE POLYOXYMETHYLENE COMPOSITION BASF SE (DE) 2008-09-03 EP disclosed