SCHEMBL8203702

SCHEMBL8203702

CCCCOC(=O)NC(CCC(C)=O)(SC)c1ccccc1F

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.38
RAB9A P51151 5/20 0.38
LMNA P02545 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 2/20 0.38
HPGD P15428 1/20 0.38
FAAH O00519 9/20 0.38
NPC1 O15118 4/20 0.37
TDP1 Q9NUW8 2/20 0.37
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 1/20 0.35
NFKB1 P19838 1/20 0.35
STAT1 P42224 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35

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
SCHEMBL8213601 0.81 GAA (0.41) POLBSMN1; SMN2RAB9ALMNACYP1A2
SCHEMBL10415979 0.68 SMN1; SMN2 (0.66) SMN1; SMN2RAB9ALMNACYP1A2CYP2C19
SCHEMBL5420579 0.67 POLB (0.51) POLBSMN1; SMN2RAB9ALMNACYP1A2
SCHEMBL21059237 0.65 CYP1A2 (0.61) POLBSMN1; SMN2LMNACYP1A2CYP2C19
SCHEMBL2717245 0.64 KCNN4 (0.38) CYP1A2CYP2C19TSHRALDH1A1
SCHEMBL21059191 0.64 SMN1; SMN2 (0.60) SMN1; SMN2RAB9ALMNACYP1A2CYP2C19
SCHEMBL8800372 0.64 CYP1A2 (0.47) SMN1; SMN2RAB9ALMNACYP1A2CYP2C19
SCHEMBL9391326 0.64 POLB (0.47) POLBSMN1; SMN2RAB9ALMNACYP1A2
SCHEMBL3870702 0.64 POLB (0.45) POLBSMN1; SMN2RAB9ALMNACYP1A2
SCHEMBL9729337 0.63 KCNN4 (0.39) CYP1A2CYP2C19TSHRALDH1A1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed