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SCHEMBL18697229

SCHEMBL18697229

CC1(C)CC2(CC(=O)N(c3ccc(Cc4ccc(N5C(=O)CC6(CC(C)(C)N(Oc7ccccc7)C(C)(C)C6)OC5=O)cc4)cc3)C(=O)O2)CC(C)(C)N1Oc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TRIP13 Q15645 1/20 0.32
▸ ELANE P08246 1/20 0.31
▸ CTSG P08311 1/20 0.31
▸ PRTN3 P24158 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ FAAH O00519 1/20 0.31
▸ MGLL Q99685 1/20 0.31
▸ TNKS O95271 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
SCHEMBL18697204 0.91 ALDH1A1 (0.35) KMT2AHPGDELANEMEN1TNKS
SCHEMBL10124704 0.82 TRIP13 (0.33) TRIP13FAAHMGLL
SCHEMBL10124693 0.79 ALDH1A1 (0.39) KMT2AHPGDELANEMEN1TNKS
SCHEMBL10124692 0.79 ALDH1A1 (0.36) KMT2AHPGDELANEMEN1
SCHEMBL13050168 0.78 ALDH1A1 (0.35) KMT2AHPGDELANEMEN1TNKS
SCHEMBL10124695 0.77 ELANE (0.33) ELANE
SCHEMBL10124697 0.74 GRM2 (0.35) KMT2AHPGDELANEMEN1TSHR
SCHEMBL10124696 0.73 MT-CO2 (0.33) TNKS
SCHEMBL18697264 0.72 ELANE (0.35) HPGDELANECTSGPRTN3MGLL
SCHEMBL13050166 0.66 TRIP13 (0.38) HPGDTRIP13FAAHMGLL

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
EP-2440557-B1 NOVEL STERICALLY HINDERED AMINE LIGHT STABILIZERS BASF SE (DE) 2017-04-05 — — EP disclosed