SCHEMBL11275608

SCHEMBL11275608

CC(C)CCCCCC(=O)C=CC1=CC=CCC1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DEGS1 O15121 1/20 0.33
APP P05067 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
CYP2C19 P33261 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4C Q9H3R0 2/20 0.31
KDM4A O75164 1/20 0.31
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL11265487 0.95 KDM1A (0.31) POLB
SCHEMBL11258370 0.89 NPC1 (0.32) POLB
SCHEMBL11261901 0.82 NPC1 (0.34)
SCHEMBL8045448 0.74 KDM4C (0.34) DEGS1MEN1CYP1A2POLBCYP3A4
SCHEMBL21081784 0.72 KDM4C (0.46) DEGS1MEN1CYP1A2POLBCYP3A4
SCHEMBL7915791 0.68
SCHEMBL10848648 0.68 IAPP (0.52) DEGS1APPMEN1CYP1A2POLB
SCHEMBL142532 0.68 PPARG (0.30) DEGS1
SCHEMBL14587560 0.64 KDM4C (0.39) DEGS1MEN1CYP1A2POLBCYP3A4
SCHEMBL13170172 0.64 KDM4C (0.39) DEGS1MEN1CYP1A2POLBCYP3A4

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-0010740-B1 SPIRODIPYRANES AND THEIR USE AS COLOUR FORMERS IN COPYING PROCESSES BASF Aktiengesellschaft (DE) 1982-04-21 EP disclosed
EP-0010740-A1 Spirodipyranes and their use as colour formers in copying processes BASF Aktiengesellschaft (DE) 1980-05-14 EP disclosed