SCHEMBL7408757

SCHEMBL7408757

O=C(OC1CCc2[nH]c3c(Oc4ccccc4)cccc3c2C1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.39
SCN1A P35498 2/20 0.39
SCN2A Q99250 2/20 0.39
SCN3A Q9NY46 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
BRAF P15056 1/20 0.38
APOBEC3A P31941 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
GAA P10253 1/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
GFER P55789 1/20 0.36
PRMT5 O14744 1/20 0.35
EGFR P00533 1/20 0.35
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35

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
SCHEMBL7409033 0.89 GAA (0.39) BRAFGAAPRMT5EGFR
SCHEMBL7404609 0.84 APOBEC3A (0.42) CHRNA7MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL7412807 0.84 CHRNA7 (0.41) CHRNA7SCN1ASCN2ASCN3AMEN1
SCHEMBL7408135 0.82 SSTR3 (0.39) CHRNA7SCN1ASCN2ASCN3AMEN1
SCHEMBL7407777 0.81 NR2E1 (0.53) CHRNA7MEN1KMT2AAPOBEC3AAPOBEC3G
Hydrochloric Acid SCHEMBL7417242 0.80 NR2E1 (0.52) CHRNA7MEN1KMT2AAPOBEC3AAPOBEC3G
SCHEMBL7413413 0.80 MCL1 (0.39) CHRNA7SCN1ASCN2ASCN3AMEN1
SCHEMBL7417014 0.79 PTPN2 (0.38) CHRNA7PRMT5EGFR
SCHEMBL7408845 0.76 CYP2C9 (0.40) CHRNA7GAAPRMT5EGFR
SCHEMBL7412750 0.76 CGAS (0.44) CHRNA7MEN1KMT2AAPOBEC3AAPOBEC3G

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
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-4062864-A ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1977-12-13 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed