SCHEMBL19954765

SCHEMBL19954765

CCCC(N)(CC)C(C)(C)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.41
KCNN4 O15554 2/20 0.38
LMNA P02545 1/20 0.37
SLC6A2 P23975 1/20 0.36
MAPK1 P28482 1/20 0.34
KIF11 P52732 5/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32

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
SCHEMBL19954719 0.88 TAAR1 (0.46) TAAR1KCNN4LMNASLC6A2MAPK1
SCHEMBL813383 0.79 TAAR1 (0.41) TAAR1KCNN4LMNAMAPK1KIF11
SCHEMBL28366875 0.78 KCNN4 (0.42) TAAR1KCNN4LMNASLC6A2KIF11
SCHEMBL19954685 0.77 TAAR1 (0.48) TAAR1KCNN4LMNASLC6A2MAPK1
SCHEMBL19954687 0.76 SIGMAR1 (0.34) LMNA
SCHEMBL28807710 0.75 TAAR1 (0.46) TAAR1KCNN4SLC6A2MAPK1KIF11
SCHEMBL157809 0.74 KCNN4 (0.48) TAAR1KCNN4SLC6A2MAPK1KIF11
SCHEMBL19954767 0.74 TAAR1 (0.42) TAAR1KCNN4LMNASLC6A2MAPK1
SCHEMBL9756593 0.73 KCNN4 (0.46) TAAR1KCNN4SLC6A2MAPK1KIF11
SCHEMBL28366818 0.73 KCNN4 (0.46) TAAR1KCNN4SLC6A2MAPK1KIF11

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
US-9917273-B2 Cross-linking polymer and organic electroluminescent element using same IDEMITSU KOSAN CO., LTD. (JP) 2018-03-13 US disclosed