SCHEMBL7823939

SCHEMBL7823939

CCOC(=O)c1[nH]c2c(c1C)CCCC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
BRD4 O60885 1/20 0.51
POLB P06746 2/20 0.51
MAPT P10636 2/20 0.51
HPGD P15428 4/20 0.50
ALDH1A1 P00352 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.44
TSHR P16473 4/20 0.44
GAA P10253 2/20 0.44
MAPK1 P28482 2/20 0.43
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL7956193 0.98 LMNA (0.56) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL11276300 0.86 LMNA (0.68) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL24375267 0.84 LMNA (0.55) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL2075491 0.83 LMNA (0.63) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7050246 0.81 LMNA (0.51) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL6297621 0.79 LMNA (0.49) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL20569876 0.78 ALDH1A1 (0.51) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL6696149 0.78 LMNA (0.48) LMNACYP1A2CYP2C9CYP2C19KMT2A
SCHEMBL7826327 0.78 PTK2 (0.57) LMNAKMT2AMEN1NPC1RAB9A
SCHEMBL7052350 0.77 TSHR (0.74) LMNACYP1A2CYP2C9CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1066257-A2 HETEROCYLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE Sugen, Inc. (US) 2001-01-10 EP disclosed
WO-1999048868-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 WO disclosed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 WO disclosed