SCHEMBL10447112

SCHEMBL10447112

O=C(Nc1ccc(F)cc1F)N(Cc1ccccc1)C1CCOc2ccc(Cl)cc21

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ UBE2M P61081 9/20 0.49
▸ DCUN1D1 Q96GG9 9/20 0.49
▸ THRB P10828 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ EEF2K O00418 1/20 0.38

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
SCHEMBL10447111 0.93 UBE2M (0.49) UBE2MDCUN1D1THRBKMT2APOLB
SCHEMBL10447172 0.79 RAB9A (0.41) UBE2MDCUN1D1THRBKMT2AKDM4E
SCHEMBL10446801 0.78 RAB9A (0.46) UBE2MDCUN1D1KMT2APOLBRAB9A
SCHEMBL10446671 0.76 P2RX3 (0.49) UBE2MDCUN1D1KMT2APOLBNPSR1
SCHEMBL10446624 0.75 UBE2M (0.43) UBE2MDCUN1D1KMT2APOLBRAB9A
SCHEMBL10446652 0.75 P2RX3 (0.47) UBE2MDCUN1D1POLBRAB9ANPC1
SCHEMBL10447056 0.73 UBE2M (0.51) UBE2MDCUN1D1THRBKMT2APOLB
SCHEMBL9270701 0.71 UBE2M (0.53) UBE2MDCUN1D1POLBRAB9A
SCHEMBL9270364 0.71 UBE2M (0.52) UBE2MDCUN1D1POLBRAB9ANPC1
SCHEMBL9270367 0.71 UBE2M (0.52) UBE2MDCUN1D1POLBRAB9ANPC1

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-0399422-A1 Benzocycloalkane derivatives and production thereof Takeda Chemical Industries, Ltd. (JP) 1990-11-28 — — EP disclosed
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