SCHEMBL12848699

SCHEMBL12848699

NC1CCCC(C2CCCCC2)C1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL25146996 1.00 ALDH1A1 (0.44) ALDH1A1THRBMEN1KMT2A
SCHEMBL20663106 0.97 ALDH1A1 (0.47) ALDH1A1THRBMEN1KMT2A
SCHEMBL14011423 0.97 ALDH1A1 (0.47) ALDH1A1THRBMEN1KMT2A
SCHEMBL24296707 0.97 ALDH1A1 (0.47) ALDH1A1THRBMEN1KMT2A
SCHEMBL20078810 0.94 ALDH1A1 (0.44) ALDH1A1THRBMEN1KMT2A
SCHEMBL19186534 0.92 ALDH1A1 (0.47) ALDH1A1THRBMEN1KMT2A
SCHEMBL17723850 0.91 ALDH1A1 (0.35) ALDH1A1THRBMEN1KMT2A
SCHEMBL23330446 0.89 ALDH1A1 (0.37) ALDH1A1THRBMEN1KMT2A
SCHEMBL12689882 0.89 ALDH1A1 (0.44) ALDH1A1THRBMEN1KMT2A
SCHEMBL24226852 0.89 ALDH1A1 (0.37) ALDH1A1THRBMEN1KMT2A

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
WO-2022045618-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 랩토 2022-03-03 WO disclosed
US-7904871-B2 Computer-implemented method of optimizing refraction and TIR structures to enhance path lengths in PV devices GENIE LENS TECHNOLOGIES, LLC (US) 2011-03-08 US disclosed