SCHEMBL9643103

SCHEMBL9643103

CCCCCC(=O)Oc1c(OCC)c(OCC)c(O)c2ccc(OCC)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.41
CNR2 P34972 2/20 0.40
TOP2A P11388 1/20 0.39
HTR1A P08908 1/20 0.39
HTR1B P28222 1/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALOX15 P16050 1/20 0.38
AKR1B1 P15121 1/20 0.37
LMNA P02545 1/20 0.37
BRD4 O60885 1/20 0.37

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
SCHEMBL9642678 0.95 L3MBTL1 (0.41) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9642996 0.93 L3MBTL1 (0.44) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9642101 0.87 L3MBTL1 (0.40) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9642831 0.87 L3MBTL1 (0.40) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9642584 0.80 TP53 (0.39) L3MBTL1KMT2ANPC1RAB9ATDP1
SCHEMBL9642874 0.80 TP53 (0.39) L3MBTL1KMT2ANPC1RAB9ATDP1
SCHEMBL10522637 0.79 KMT2A (0.40) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9713270 0.79 TOP2A (0.47) L3MBTL1CNR2TOP2AHTR1AHTR1B
SCHEMBL9642932 0.78 TP53 (0.46) KMT2AMAPTHSD17B10KDM4EAKR1B1
SCHEMBL9643595 0.77 MAPT (0.45) L3MBTL1MAPTHSD17B10KDM4ETDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215622-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS AND PROCESS FOR MAKING THEM SYNTEX (U.S.A.) INC. (US) 1992-06-17 EP disclosed
US-4946845-A STABLE ANTIINFLAMMATORY AGENTS, LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1990-08-07 US disclosed
US-4792556-A LIPOXYGENASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-12-20 US disclosed
EP-0215622-A2 Naphthalene anti-psoriatic agents and process for making them SYNTEX (U.S.A.) INC. (US) 1987-03-25 EP disclosed