SCHEMBL9846116

SCHEMBL9846116

CCc1cnccc1CCCCC(C)O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP2E1 P05181 3/20 0.35
CYP2C8 P10632 3/20 0.35
CYP2D6 P10635 3/20 0.35
CYP2A6 P11509 3/20 0.35
CYP2B6 P20813 3/20 0.35
CYP2C19 P33261 3/20 0.35
TBXAS1 P24557 6/20 0.34
AOC1 P19801 2/20 0.33
AOC3 Q16853 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP3A4 P08684 1/20 0.32
TYR P14679 2/20 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
SCHEMBL9846235 0.84 CYP2E1 (0.35) L3MBTL1LMNASMN1; SMN2CYP2E1CYP2C8
SCHEMBL9846170 0.84 CYP2E1 (0.35) L3MBTL1LMNASMN1; SMN2CYP2E1CYP2C8
SCHEMBL9820954 0.78 TDP1 (0.49) L3MBTL1LMNACYP2E1CYP2C8CYP2D6
SCHEMBL27335859 0.78 AOC1 (0.41) L3MBTL1LMNASMN1; SMN2CYP2E1CYP2C8
SCHEMBL10435113 0.78 TDP1 (0.49) L3MBTL1LMNACYP2E1CYP2C8CYP2D6
SCHEMBL9846289 0.75 CYP2E1 (0.39) CYP2E1CYP2C8CYP2D6CYP2A6CYP2B6
SCHEMBL9588426 0.75 RIPK1 (0.38) L3MBTL1LMNASMN1; SMN2TBXAS1
SCHEMBL9846259 0.74 CYP2E1 (0.36) L3MBTL1CYP2E1CYP2C8CYP2D6CYP2A6
SCHEMBL9588340 0.74 TDP1 (0.49) L3MBTL1TBXAS1TDP1
SCHEMBL8271491 0.74 CYP2E1 (0.49) L3MBTL1CYP2E1CYP2C8CYP2D6CYP2A6

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-0424538-A1 PYRIDINE DERIVATIVES AND THEIR SALTS, AND INSECTICIDAL/ACARICIDAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-05-02 EP disclosed