SCHEMBL9200628

SCHEMBL9200628

COC(=O)c1c(NC(=O)c2ccc(C(=O)Nc3c[nH]c(C)c3C(=O)OC)cc2)c[nH]c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.54
MAPT P10636 4/20 0.52
LMNA P02545 3/20 0.52
POLB P06746 3/20 0.52
HPGD P15428 5/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
F10 P00742 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPK10 P53779 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KMT2A Q03164 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL9200462 0.93 HTT (0.61) HTTMAPTLMNAPOLBHPGD
SCHEMBL9208183 0.85 HTT (0.51) HTTMAPTLMNAPOLBHPGD
SCHEMBL9199991 0.82 HTT (0.54) HTTMAPTLMNAPOLBHPGD
SCHEMBL9210017 0.80 SMN1; SMN2 (0.56) HTTMAPTLMNAPOLBHPGD
SCHEMBL9203467 0.79 HTT (0.46) HTTMAPTPOLBHPGDALDH1A1
SCHEMBL9209144 0.78 POLB (0.54) HTTMAPTPOLBHPGDCYP1A2
SCHEMBL9203585 0.77 SMN1; SMN2 (0.49) HTTMAPTPOLBHPGDALDH1A1
SCHEMBL9205844 0.77 HTT (0.49) HTTMAPTLMNAHPGDALDH1A1
SCHEMBL9200259 0.77 HTT (0.49) HTTMAPTLMNAHPGDALDH1A1
SCHEMBL9205320 0.77 HTT (0.49) HTTMAPTLMNAPOLBALDH1A1

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-0390739-B1 Substituted aminopyrroles as stabilisers in chlorinated polymers CIBA GEIGY AG (CH) 1995-08-09 EP disclosed
US-5155152-A SUBSTITUTE AMINOPYRROLES AS STABILIZERS FOR CHLORINE-CONTAINING POLYMERS CIBA-GEIGY CORPORATION (US) 1992-10-13 US disclosed
EP-0390739-A2 Substituted aminopyrroles as stabilisers in chlorinated polymers CIBA-GEIGY AG (CH) 1990-10-03 EP disclosed