SCHEMBL11201043

SCHEMBL11201043

CC(Cl)C(Nc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
ALDH1A1 P00352 6/20 0.49
GAA P10253 5/20 0.49
LMNA P02545 4/20 0.49
ATM Q13315 3/20 0.49
TDP1 Q9NUW8 2/20 0.48
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
HSD17B10 Q99714 3/20 0.47
CYP3A4 P08684 3/20 0.47
TSHR P16473 3/20 0.47
ALOX15 P16050 2/20 0.47
ALOX12 P18054 2/20 0.47
THRB P10828 1/20 0.47
RECQL P46063 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NAPRT Q6XQN6 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL2159141 0.84 LMNA (0.59) MAPTALDH1A1GAALMNAATM
SCHEMBL3876430 0.84 MAPT (0.47) MAPTALDH1A1GAALMNAATM
SCHEMBL2159137 0.84 LMNA (0.59) MAPTALDH1A1GAALMNAATM
SCHEMBL8745550 0.84 LMNA (0.59) MAPTALDH1A1GAALMNAATM
Hydrochloric Acid SCHEMBL11195536 0.82 LMNA (0.57) MAPTALDH1A1GAALMNAATM
Benzene SCHEMBL27670933 0.82 TDP1 (0.50) MAPTALDH1A1GAALMNAATM
SCHEMBL11194066 0.82 TDP1 (0.50) MAPTALDH1A1GAALMNAATM
Hydrochloric Acid SCHEMBL11195541 0.82 LMNA (0.57) MAPTALDH1A1GAALMNAATM
SCHEMBL28812355 0.79 CA12 (0.47) MAPTALDH1A1GAALMNAATM
SCHEMBL5327844 0.78 TDP1 (0.45) MAPTALDH1A1GAALMNAATM

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
US-4411912-A Insecticidal isovaleric acid esters ZOECON CORPORATION (US) 1983-10-25 US disclosed
US-4243819-A Substituted amino acids ZOECON CORPORATION (US) 1981-01-06 US disclosed