SCHEMBL27412938

SCHEMBL27412938

CCCn1c(C(C)C)cc2cc(C(C)C)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RORA P35398 1/20 0.41
▸ RORC P51449 1/20 0.41
▸ RORB Q92753 1/20 0.41
▸ CASR P41180 6/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CTSK P43235 1/20 0.33
▸ MIF P14174 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32

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
SCHEMBL22479058 0.87 GRIK1 (0.37) RORARORCRORBCASRALDH1A1
SCHEMBL19531667 0.80 POLB (0.42) ALDH1A1KDM4EMEN1GAAKMT2A
SCHEMBL21730433 0.78 LMNA (0.35) RORARORCRORBALDH1A1KDM4E
SCHEMBL13921917 0.76 RORA (0.58) RORARORCRORBALDH1A1KDM4E
SCHEMBL24513016 0.73 MEN1 (0.43) RORARORCRORBALDH1A1KDM4E
SCHEMBL20646947 0.73 PSEN1 (0.45) RORARORCRORBCASRALDH1A1
SCHEMBL22515646 0.72 RORA (0.36) RORARORCRORBCASRGAA
SCHEMBL11527429 0.72 KMT2A (0.48) RORARORCRORBKDM4EGAA
SCHEMBL12827380 0.71 AKR1C3 (0.42) RORARORCRORBALDH1A1KDM4E
SCHEMBL9613205 0.71 GPR35 (0.57) ALDH1A1KDM4EHPGDPOLB

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-4097099-B1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO INC (US) 2024-06-26 — — EP disclosed
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