SCHEMBL7731802

SCHEMBL7731802

CC(OC(C)(C)C)N(C)c1ccc(N(C)C(C)OC(C)(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL7731807 0.78
SCHEMBL7733728 0.73 ALDH1A1 (0.36) ALDH1A1ALOX15TSHRHSD17B10HTT
SCHEMBL7733231 0.72 NR1H2 (0.33) ALDH1A1LMNAHTT
SCHEMBL12888006 0.69
SCHEMBL18384525 0.69
SCHEMBL7723637 0.68 LMNA (0.36) ALDH1A1ALOX15TSHRHSD17B10LMNA
SCHEMBL11577368 0.64 SLC6A2 (0.38) ALDH1A1LMNAHTTNPSR1
SCHEMBL23789498 0.62
SCHEMBL16981023 0.61 MLYCD (0.40) ALDH1A1TSHRHSD17B10
SCHEMBL11677647 0.61 MAOA (0.42) LMNAHTTNPSR1

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-6399272-B1 Phenylenediamine derivative-type additive useful for a chemically amplified photoresist HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) 2002-06-04 US disclosed