SCHEMBL21173500

SCHEMBL21173500

CN(C)c1cccc(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ TSHR P16473 4/20 0.42
▸ HSD17B10 Q99714 2/20 0.40
▸ SLC2A1 P11166 1/20 0.39
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ ALOX15 P16050 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TYR P14679 1/20 0.34
▸ TERT O14746 1/20 0.34
▸ APP P05067 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HDAC8 Q9BY41 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP1A2 P05177 1/20 0.33

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
SCHEMBL14163856 0.89 CYP2D6 (0.44) ALDH1A1TSHRMEN1KMT2ARAB9A
SCHEMBL14489808 0.84 MEN1 (0.41) ALDH1A1MEN1KMT2ARAB9ANPSR1
SCHEMBL21227694 0.84 SLC2A1 (0.54) ALDH1A1TSHRHSD17B10SLC2A1MEN1
SCHEMBL15641801 0.82 PTGES (0.43) ALDH1A1MEN1KMT2ARAB9ANPSR1
SCHEMBL21173402 0.81 TSHR (0.45) ALDH1A1TSHRMEN1KMT2ARAB9A
SCHEMBL15481639 0.80 ALDH1A1 (0.44) ALDH1A1TSHRMEN1KMT2ARAB9A
SCHEMBL21173428 0.80 KMT2A (0.37) ALDH1A1TSHRMEN1KMT2ARAB9A
SCHEMBL26662921 0.80 ALDH1A1 (0.50) ALDH1A1TSHRHSD17B10MEN1KMT2A
SCHEMBL22915558 0.80 MEN1 (0.50) ALDH1A1TSHRMEN1KMT2ARAB9A
SCHEMBL21173504 0.80 HDAC6 (0.41) ALDH1A1TSHRKMT2ARAB9ANPSR1

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-20190221375-A1 PHOTOELECTRIC CONVERSION ELEMENT, DYE-SENSITIZED SOLAR CELL, METAL COMPLEX DYE, DYE SOLUTION, AND OXIDE SEMICONDUCTOR ELECTRODE FUJIFILM CORPORATION (JP) 2019-07-18 — — US disclosed
Send feedback