SCHEMBL16326281

SCHEMBL16326281

CN(CCOCCOc1ccc(C(C)(C)CC(C)(C)C)cc1)Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 5/20 0.61
▸ SMN1; SMN2 Q16637 4/20 0.61
▸ CYP3A4 P08684 3/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ LMNA P02545 3/20 0.61
▸ TDP1 Q9NUW8 3/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ APAF1 O14727 2/20 0.61
▸ USP2 O75604 2/20 0.61
▸ ERBB2 P04626 2/20 0.61
▸ TP53 P04637 2/20 0.61
▸ FYN P06241 2/20 0.61
▸ CHRM2 P08172 2/20 0.61
▸ CHRM4 P08173 2/20 0.61
▸ CHRM5 P08912 2/20 0.61
▸ ADRA2A P08913 2/20 0.61
▸ MAPT P10636 2/20 0.61
▸ HSPD1 P10809 2/20 0.61
▸ CHRM1 P11229 2/20 0.61

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
Hydrochloric Acid SCHEMBL426559 0.99 TSHR (0.60) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL17751130 0.87 MEN1 (0.57) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL10093504 0.83 KMT2A (0.56) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL14950044 0.82 KMT2A (0.58) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL171239 0.82 SMN1; SMN2 (0.59) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
Hydrochloric Acid SCHEMBL16993807 0.81 SMN1; SMN2 (0.57) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL26657537 0.81 SMN1; SMN2 (0.67) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
Water SCHEMBL6924231 0.81 SMN1; SMN2 (0.57) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL19074259 0.77 LMNA (0.63) TSHRSMN1; SMN2CYP3A4MEN1KMT2A
SCHEMBL10093501 0.77 LMNA (0.50) TSHRSMN1; SMN2CYP3A4MEN1KMT2A

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-8292995-B2 Sulfonated dye salts having improved stability SILVERBROOK RESEARCH PTY LTD (AU) 2012-10-23 — — US disclosed
US-8038737-B2 Method of modulating stability of sulfonated dye SILVERBROOK RESEARCH PTY LTD (AU) 2011-10-18 — — US disclosed
US-20090199352-A1 METHOD OF MODULATING STABILITY OF SULFONATED DYE SILVERBROOK RESEARCH PTY LTD 2009-08-13 — — US disclosed
US-20090202799-A1 SULFONATED DYE SALTS HAVING IMPROVED STABILITY SILVERBROOK RESEARCH PTY LTD 2009-08-13 — — US disclosed
Send feedback