SCHEMBL9749890

SCHEMBL9749890

CCOC(=O)Oc1cc2c(C=C[N+](=O)[O-])ccc(OCc3ccccc3)c2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
LMNA P02545 7/20 0.47
ALDH1A1 P00352 7/20 0.47
HPGD P15428 5/20 0.47
NPSR1 Q6W5P4 5/20 0.47
NTSR1 P30989 2/20 0.47
ALOX12 P18054 1/20 0.47
CCR6 P51684 1/20 0.47
MCL1 Q07820 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MAPK1 P28482 3/20 0.45
TLR9 Q9NR96 2/20 0.45
S1PR4 O95977 1/20 0.45
ITGA4 P13612 1/20 0.45
S1PR1 P21453 1/20 0.45
HTT P42858 1/20 0.45
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43

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
SCHEMBL9749326 0.86 KDM4E (0.40) MAPTLMNAALDH1A1HPGDNPC1
SCHEMBL9749833 0.81 SRD5A2 (0.39) MAPTLMNAALDH1A1HPGDSMN1; SMN2
SCHEMBL9749856 0.76 TRPM8 (0.45) MAPTKDM4E
SCHEMBL9749338 0.74 MAPT (0.55) MAPTLMNAALDH1A1HPGDNPSR1
SCHEMBL10925785 0.74 SRD5A2 (0.46) MAPTMAPK1TDP1L3MBTL1
SCHEMBL9749330 0.74 MAPT (0.55) MAPTLMNAALDH1A1HPGDNPSR1
SCHEMBL10926127 0.73 L3MBTL1 (0.42) MAPTLMNAALDH1A1NPC1RAB9A
SCHEMBL10926951 0.71 MAPT (0.35) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL10510005 0.71 SRD5A2 (0.43) MAPTLMNAALDH1A1HPGDNPC1
SCHEMBL10926398 0.69 L3MBTL1 (0.46) MAPTLMNAALDH1A1HPGDMCL1

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-0266349-B1 TRICYCLIC INDOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS MEDICINES SCHERING AKTIENGESELLSCHAFT (DE) 1992-03-18 EP disclosed
EP-0266349-A1 TRICYCLIC INDOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS MEDICINES. SCHERING AG (DE) 1988-05-11 EP disclosed
WO-1987000522-A1 TRICYCLIC INDOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS MEDICINES SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) 1987-01-29 WO disclosed