SCHEMBL9588229

SCHEMBL9588229

CCc1cnccc1C(C)CC(C)CCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
TSHR P16473 1/20 0.35
FPR1 P21462 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
TRPA1 O75762 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL9586748 0.89 LMNA (0.47) LMNAL3MBTL1SMN1; SMN2HTR1ADRD2
SCHEMBL9588159 0.86 LMNA (0.40) LMNAL3MBTL1SMN1; SMN2ALDH1A1CYP1A2
SCHEMBL9587717 0.84 LMNA (0.42) LMNAL3MBTL1CYP2C9CYP2C19TDP1
SCHEMBL9587287 0.82 LMNA (0.43) LMNAL3MBTL1SMN1; SMN2HTR1ADRD2
SCHEMBL9586876 0.82 TDP1 (0.43) LMNAL3MBTL1TDP1
SCHEMBL9587199 0.80 LMNA (0.43) LMNASMN1; SMN2HTR1ADRD2ALDH1A1
SCHEMBL9587755 0.80 LMNA (0.40) LMNAL3MBTL1HTR1ADRD2ALDH1A1
SCHEMBL9589207 0.79 LMNA (0.43) LMNAL3MBTL1SMN1; SMN2HTR1ADRD2
SCHEMBL9588808 0.77 TDP1 (0.41) LMNAL3MBTL1SMN1; SMN2HTR1ADRD2
SCHEMBL9589519 0.77 SMN1; SMN2 (0.43) LMNAL3MBTL1SMN1; SMN2

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-5262420-A Phenylalkylpyridines IDEMITSU KOSAN CO., LTD. (JP) 1993-11-16 US claimed