SCHEMBL9377865

SCHEMBL9377865

COc1ccc(NC(=O)C(=O)Nc2ccc(C(=O)NN)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.77
CA2 P00918 2/20 0.77
NPC1 O15118 9/20 0.70
RAB9A P51151 7/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
TP53 P04637 3/20 0.70
ALOX15 P16050 1/20 0.70
ALDH1A1 P00352 4/20 0.61
MAPT P10636 3/20 0.61
KDM4E B2RXH2 2/20 0.61
CYP1A2 P05177 2/20 0.61
HTT P42858 1/20 0.61
KCNH2 Q12809 1/20 0.56
KMT2A Q03164 4/20 0.55
MEN1 O00255 3/20 0.55
CYP3A4 P08684 1/20 0.55
GAA P10253 1/20 0.55
CYP2D6 P10635 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55

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
SCHEMBL407188 0.88 CA1 (1.00) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL9501086 0.86 KDM4E (0.65) CA1CA2NPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL4259929 0.86 CA1 (0.96) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL6396790 0.84 RAB9A (0.76) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL7318116 0.83 CA1 (0.89) CA1CA2NPC1RAB9ASMN1; SMN2
SCHEMBL6799157 0.83 RAB9A (1.00) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL9377732 0.80 PTPN1 (0.58) NPC1RAB9AALDH1A1KDM4EKMT2A
SCHEMBL11462217 0.79 RAB9A (0.83) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL6816201 0.79 RAB9A (0.83) NPC1RAB9ASMN1; SMN2TP53ALOX15
SCHEMBL14490986 0.79 RAB9A (0.83) NPC1RAB9ASMN1; SMN2TP53ALOX15

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-0308886-B1 Dianhydride coupled polymer stabilizers ATOCHEM NORTH AMERICA (US) 1994-11-23 EP disclosed
US-4874803-A HEAT AND OXIDATION RESISTANCE; PHOTOSTABILITY PENNWALT CORPORATION (US) 1989-10-17 US disclosed
EP-0308886-A2 Dianhydride coupled polymer stabilizers ATOCHEM NORTH AMERICA, INC. (US) 1989-03-29 EP disclosed