SCHEMBL7936307

SCHEMBL7936307

CC[n+]1c(C)ccc2cc(C)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.46
MAPT P10636 7/20 0.46
LMNA P02545 7/20 0.46
HTT P42858 7/20 0.45
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.45
SMN1; SMN2 Q16637 5/20 0.45
NPC1 O15118 5/20 0.45
POLB P06746 5/20 0.45
MAPK1 P28482 4/20 0.45
NPSR1 Q6W5P4 4/20 0.45
ALPL P05186 3/20 0.45
ALPI P09923 3/20 0.45
ALPG P10696 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
BLM P54132 1/20 0.45
CYP2A6 P11509 3/20 0.44
CYP1A2 P05177 3/20 0.44
RAB9A P51151 5/20 0.44
ALDH1A1 P00352 5/20 0.44

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
Iodide SCHEMBL4885250 0.98 MAPT (0.49) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL13652061 0.81 KDM4E (0.44) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL38654677 0.81 KDM4E (0.37) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL13651949 0.79 CYP2A6 (0.42) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL1049882 0.76 KDM4E (0.53) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL25672216 0.76 MEN1 (0.46) KDM4EMAPTLMNAHTTKMT2A
Iodide SCHEMBL29227333 0.74 KDM4E (0.51) KDM4EMAPTLMNAHTTKMT2A
Hydrochloric Acid SCHEMBL6333076 0.74 KDM4E (0.51) KDM4EMAPTLMNAHTTKMT2A
Iodide SCHEMBL82245 0.74 ALDH1A1 (0.51) KDM4EMAPTLMNAHTTKMT2A
SCHEMBL10167906 0.74 CYP1A2 (0.50) KDM4EMAPTLMNAHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6241873-B1 SOLID ELECTROLYTE FORMED BY HEAT TREATING POLYMER HAVING QUATERNARY AMMONIUM GROUP IN ITS MAIN CHAIN AND HAVING HALIDE ION AS COUNTER ION, AND METAL HALIDE AT AT LEAST 100 DEGREES C. TDK CORPORATION (JP) 2001-06-05 US disclosed
EP-1056434-A1 DYEING METHOD USING A SPECIFIC CATIONIC DERIVATIVE AND A COMPOUND SELECTED AMONG A SPECIFIC ALDEHYDE, A SPECIFIC KETONE, A QUINONE AND A DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVE L'OREAL (FR) 2000-12-06 EP disclosed
WO-2000038639-A1 DYEING METHOD USING A SPECIFIC CATIONIC DERIVATIVE AND A COMPOUND SELECTED AMONG A SPECIFIC ALDEHYDE, A SPECIFIC KETONE, A QUINONE AND A DI-IMINO-ISOINDOLINE OR 3-AMINO-ISOINDOLONE DERIVATIVE L'OREAL (FR) 2000-07-06 WO disclosed