Benzene

Benzene

SCHEMBL27670933

CC(O)C(Nc1ccccc1)C(=O)O.c1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 4/20 0.49
GAA P10253 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 4/20 0.48
ALDH1A1 P00352 3/20 0.48
TSHR P16473 3/20 0.48
CYP3A4 P08684 2/20 0.48
ALOX15 P16050 2/20 0.48
ALOX12 P18054 2/20 0.48
THRB P10828 1/20 0.48
RECQL P46063 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MME P08473 1/20 0.45

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
SCHEMBL11194066 1.00 TDP1 (0.50) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL2159141 0.86 LMNA (0.59) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL8745550 0.86 LMNA (0.59) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL2159137 0.86 LMNA (0.59) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL28169679 0.85 TDP1 (0.47) TDP1LMNAGAASMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL11195536 0.84 LMNA (0.57) TDP1LMNAGAASMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL11195541 0.84 LMNA (0.57) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL868433 0.83 CA12 (0.45) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL625123 0.83 CA12 (0.45) TDP1LMNAGAASMN1; SMN2HPGD
SCHEMBL11201043 0.82 MAPT (0.49) TDP1LMNAGAASMN1; SMN2HPGD

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
CN-1816337-A Naphthalene-containing melanocortin receptor-specific small molecule PALATIN TECHNOLOGIES INC (US) 2006-08-09 CN disclosed