SCHEMBL14337540

SCHEMBL14337540

CCCC(N)Oc1ccc(C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.38
▸ TEAD4 Q15561 1/20 0.38
▸ KMT2A Q03164 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ MAPT P10636 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ POLB P06746 2/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ WDR5 P61964 1/20 0.36
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ PPARG P37231 2/20 0.34
▸ PPARA Q07869 2/20 0.34
▸ NLRP1 Q9C000 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ LTA4H P09960 1/20 0.34
▸ CYP3A4 P08684 1/20 0.33

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
SCHEMBL15500085 0.85 SLC2A1 (0.46) KMT2AMEN1PPARGPPARA
SCHEMBL10550130 0.83 ACHE (0.41) ACHETEAD4KMT2AMEN1MAPT
SCHEMBL3227309 0.82 SLC6A4 (0.41) PPARGPPARALMNALTA4H
SCHEMBL27566411 0.78 P2RX3 (0.42) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL8797285 0.77 THRB (0.35) CA2CA1PPARGPPARA
SCHEMBL10694597 0.76 KMT2A (0.40) ACHEKMT2AMEN1MAPTALDH1A1
SCHEMBL8549081 0.76 PPARG (0.41) ACHETEAD4KMT2AMEN1MAPT
SCHEMBL15871120 0.76 ACHE (0.38) ACHETEAD4KMT2AMEN1MAPT
Acetic Acid SCHEMBL7350375 0.74 PPARG (0.45) ALDH1A1POLBTDP1PPARGPPARA
Hydrochloric Acid SCHEMBL444910 0.73 MAPT (0.50) KMT2AMEN1MAPTTDP1CA2

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-7311391-B2 Ink composition and ink jet recording method FUJIFILM CORPORATION (JP) 2007-12-25 — — US disclosed
Send feedback