SCHEMBL11555709

SCHEMBL11555709

CCCCCCCCCCOc1ccc(C(=O)OCCN(CC)CC)o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ TDP1 Q9NUW8 1/20 0.61
▸ SCN1A P35498 6/20 0.47
▸ SCN2A Q99250 6/20 0.47
▸ SCN3A Q9NY46 6/20 0.47
▸ CYP2D6 P10635 4/20 0.47
▸ TSHR P16473 4/20 0.47
▸ HRH3 Q9Y5N1 3/20 0.47
▸ CYP1A2 P05177 3/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ SLC6A2 P23975 1/20 0.47
▸ SLC6A3 Q01959 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ LMNA P02545 4/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ RAD52 P43351 1/20 0.46
▸ MAOA P21397 2/20 0.45
▸ HTR3A P46098 1/20 0.45

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
SCHEMBL11561313 1.00 MEN1 (0.61) MEN1KMT2ATDP1SCN1ASCN2A
SCHEMBL991408 0.89 MEN1 (0.63) MEN1KMT2ATDP1SCN1ASCN2A
SCHEMBL18013744 0.88 TDP1 (0.73) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL11852023 0.86 MEN1 (0.56) MEN1KMT2ATDP1SCN1ASCN2A
SCHEMBL991809 0.86 MEN1 (0.66) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL11554831 0.84 MEN1 (0.71) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL11558044 0.84 MEN1 (0.71) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL992355 0.83 MEN1 (0.66) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL18256284 0.83 MEN1 (0.66) MEN1KMT2ATDP1TSHRLMNA
SCHEMBL19821665 0.81 MEN1 (0.66) MEN1KMT2ATDP1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4146623-A SUBSTITUTED FUROIC ACIDS AND ESTERS RICHARDSON-MERRELL INC. (US) 1979-03-27 — — US disclosed
US-4110351-A Hypolipidemic agents RO- or RS- substituted furoic acids, esters and salts RICHARDSON-MERRELL INC. (US) 1978-08-29 — — US disclosed
Send feedback