SCHEMBL24016940

SCHEMBL24016940

Cc1cccc(C)c1C(=O)N1CCC[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)[C@@H]1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UBE2M P61081 4/20 0.52
▸ DCUN1D1 Q96GG9 4/20 0.52
▸ KDM4E B2RXH2 3/20 0.49
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ EPHX2 P34913 3/20 0.48
▸ USP2 O75604 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ RAB9A P51151 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ HCRTR1 O43613 1/20 0.47
▸ HCRTR2 O43614 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ TP53 P04637 1/20 0.44

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
SCHEMBL18790113 0.91 ALDH1A1 (0.44) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL18790110 0.87 UBE2M (0.51) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL13326991 0.87 UBE2M (0.51) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL18532611 0.87 HCRTR1 (0.41) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL14960484 0.87 UBE2M (0.51) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL25132778 0.85 EPHX2 (0.43) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL20879820 0.85 LMNA (0.56) KDM4EMEN1KMT2AALDH1A1USP2
SCHEMBL20879814 0.85 ALDH1A1 (0.53) KDM4EMEN1KMT2AALDH1A1LMNA
SCHEMBL12176202 0.85 UBE2M (0.46) UBE2MDCUN1D1KDM4EMEN1KMT2A
SCHEMBL20879776 0.84 ALDH1A1 (0.45) UBE2MDCUN1D1ALDH1A1USP2LMNA

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-3508477-B1 C5AR ANTAGONISTS CHEMOCENTRYX INC (US) 2021-11-10 — — EP disclosed
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