SCHEMBL9849002

SCHEMBL9849002

O=C(NC(=O)c1ccccc1Cl)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMO Q99835 1/20 0.67
POLB P06746 1/20 0.62
KCNK3 O14649 1/20 0.61
KCNK9 Q9NPC2 1/20 0.61
ALDH1A1 P00352 1/20 0.55
MAPT P10636 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
CYP1A2 P05177 1/20 0.55
HPGD P15428 1/20 0.55
CYP2C19 P33261 1/20 0.55
PYGL P06737 1/20 0.54
KDM4E B2RXH2 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52

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
SCHEMBL28359528 0.87 TSHR (0.56) SMOPOLBKCNK3KCNK9MAPT
SCHEMBL19893245 0.84 POLB (0.67) SMOPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL304416 0.82 POLB (0.69) POLBALDH1A1SMN1; SMN2CYP1A2HPGD
SCHEMBL76489 0.81 ALDH1A1 (0.67) POLBALDH1A1MAPTSMN1; SMN2CYP1A2
SCHEMBL31078118 0.80 SMO (1.00) SMOKCNK3KCNK9MAPTSMN1; SMN2
SCHEMBL18132372 0.80 ALDH1A1 (0.58) POLBALDH1A1MAPTMEN1KMT2A
Chlorobenzene SCHEMBL28816973 0.79 NPC1 (0.61) POLBKCNK3KCNK9ALDH1A1MAPT
Hydrochloric Acid SCHEMBL27693713 0.79 ALDH1A1 (0.64) POLBALDH1A1MAPTSMN1; SMN2CYP1A2
SCHEMBL9118696 0.78 POLB (0.64) SMOPOLBALDH1A1SMN1; SMN2CYP1A2
SCHEMBL10593626 0.78 POLB (0.64) POLBALDH1A1MAPTCYP1A2HPGD

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
EP-0458197-A2 Use of N-haloamides as photoinitiators for free-radical polymerizations MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1991-11-27 EP disclosed