SCHEMBL11577402

SCHEMBL11577402

CCN1CCC(Nc2cccc(C(F)(F)F)c2)C1

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ UBE2M P61081 7/20 0.63
▸ DCUN1D1 Q96GG9 7/20 0.63
▸ MEN1 O00255 1/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ KDM4E B2RXH2 1/20 0.59
▸ LMNA P02545 1/20 0.55
▸ ROCK2 O75116 1/20 0.53
▸ IDH2 P48735 1/20 0.50
▸ EPHX2 P34913 1/20 0.49
▸ MLNR O43193 2/20 0.48
▸ DRD2 P14416 1/20 0.47
▸ PHGDH O43175 2/20 0.47

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
SCHEMBL4750850 0.85 DRD2 (0.63) UBE2MDCUN1D1MEN1KMT2AKDM4E
SCHEMBL24781281 0.83 IDH2 (0.62) UBE2MDCUN1D1MEN1KMT2ALMNA
SCHEMBL21856366 0.82 DCUN1D1 (0.49) UBE2MDCUN1D1MEN1KMT2AROCK2
SCHEMBL12041199 0.81 DCUN1D1 (0.60) UBE2MDCUN1D1MEN1KMT2AKDM4E
SCHEMBL24781034 0.80 IDH2 (0.50) UBE2MDCUN1D1MEN1KMT2ALMNA
SCHEMBL18466535 0.80 KDM4E (0.47) UBE2MDCUN1D1MEN1KMT2AKDM4E
SCHEMBL21958743 0.80 EPHX2 (0.70) UBE2MDCUN1D1MEN1KMT2AEPHX2
SCHEMBL12969653 0.80 IDH2 (0.73) UBE2MDCUN1D1MEN1KMT2AKDM4E
SCHEMBL2575970 0.79 CARM1 (0.59) KDM4EROCK2
SCHEMBL15120074 0.78 PHGDH (0.54) KMT2ALMNAROCK2IDH2EPHX2

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-RE29828-E ANALGESICS, ANTIDEPRESSANTS A. H. ROBINS COMPANY, INC. (US) 1978-11-07 — — US disclosed
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