SCHEMBL7434409

SCHEMBL7434409

Cc1cccc(C)c1NC(=O)CCN1CCC(NCC(O)C2COc3ccccc3O2)CC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 1/20 0.42
DRD4 P21917 1/20 0.41
LTA4H P09960 4/20 0.40
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.37
KDM4E B2RXH2 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL7436669 0.91 ALDH1A1 (0.52) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
Hydrochloric Acid SCHEMBL7444391 0.90 ALDH1A1 (0.52) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
Acetic Acid SCHEMBL7435033 0.89 ALDH1A1 (0.50) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
SCHEMBL10997887 0.87 LMNA (0.46) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
SCHEMBL7440356 0.86 POLB (0.43) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
SCHEMBL7435451 0.84 RAB9A (0.51) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
SCHEMBL7437173 0.83 ALDH1A1 (0.49) LMNASMN1; SMN2NPSR1ALDH1A1DRD4
SCHEMBL7434405 0.83 ATM (0.48) MAPTLMNASMN1; SMN2NPSR1ALDH1A1
SCHEMBL7439962 0.83 ALDH1A1 (0.47) LMNAALDH1A1DRD4L3MBTL1TDP1
SCHEMBL7434584 0.83 ALDH1A1 (0.47) LMNAALDH1A1DRD4L3MBTL1TDP1

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-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed