SCHEMBL11550032

SCHEMBL11550032

CC1(NCCCC(=O)c2ccc3oc4ccc(C(=O)CCCNC5(C)CCCCC5)cc4c3c2)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 1/20 0.37
▸ PTGIR P43119 1/20 0.37
▸ PTGDR Q13258 1/20 0.37
▸ STS P08842 1/20 0.35
▸ PTGS1 P23219 2/20 0.34
▸ PTGS2 P35354 2/20 0.34
▸ HPGD P15428 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ NPC1 O15118 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HTR2B P41595 1/20 0.32
▸ LOXL2 Q9Y4K0 3/20 0.32
▸ CTNNB1 P35222 1/20 0.32

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
SCHEMBL11679296 0.81 KDM4E (0.47) PTGS1PTGS2HPGDNPC1RAB9A
SCHEMBL11551512 0.70 KDM4E (0.54) HPGDNPC1RAB9AALDH1A1KMT2A
SCHEMBL11552376 0.70 TTR (0.43) STSHPGDNPC1RAB9AALDH1A1
SCHEMBL11551105 0.69 KDM4E (0.59) HPGDNPC1RAB9AALDH1A1KMT2A
SCHEMBL11807872 0.69 DPP4 (0.36) PTGS1PTGS2HPGDNPC1RAB9A
SCHEMBL11552125 0.69 ALDH1A1 (0.52) HPGDNPC1RAB9AALDH1A1KMT2A
SCHEMBL11551446 0.68 TTR (0.42) STSNPC1RAB9AALDH1A1MAPT
SCHEMBL11550034 0.68 THRA (0.41) STSPOLBNPC1RAB9AALDH1A1
SCHEMBL11555272 0.67 TSHR (0.61) NPC1RAB9AALDH1A1KMT2AMEN1
SCHEMBL11748405 0.67 MAOB (0.52) HPGDALDH1A1MAPTKDM4E

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
US-4146624-A METHOD OF TREATING VIRUSES WITH BIS-BASIC KETONES OF DIBENZOFURAN RICHARDSON-MERRELL INC. (US) 1979-03-27 — — US disclosed
Send feedback