SCHEMBL11037240

SCHEMBL11037240

CCCCCN(CCCCC)C(Cl)(Cl)Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.43
TSHR P16473 4/20 0.37
THRB P10828 1/20 0.37
ALDH1A1 P00352 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
GBA1 P04062 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
GGPS1 O95749 1/20 0.31
FDPS P14324 1/20 0.31
AGTR1 P30556 1/20 0.31
OPRM1 P35372 1/20 0.31
PDE3A Q14432 1/20 0.31
MGLL Q99685 1/20 0.31
SLC22A1 O15245 2/20 0.30
SLC22A2 O15244 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL11034478 0.79 DNM1 (0.40) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL13152919 0.74 DNM1 (0.46) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL14997774 0.72 DNM1 (0.50) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL14997773 0.72 DNM1 (0.50) DNM1TSHRTHRBALDH1A1CA12
Nonane SCHEMBL28466423 0.72 DNM1 (0.50) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL22532181 0.72 DNM1 (0.43) DNM1TSHRTHRBCA12CA1
SCHEMBL12243063 0.72 DNM1 (0.43) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL10705836 0.72 DNM1 (0.50) DNM1TSHRTHRBALDH1A1CA12
SCHEMBL7940648 0.72 DNM1 (0.43) DNM1TSHRTHRBCA12CA1
SCHEMBL28190831 0.72 DNM1 (0.50) DNM1TSHRTHRBALDH1A1CA12

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-0052842-B1 N,N-DIARYL CARBAMOYL FLUORIDES, PROCESS FOR PREPARING THEM AND THEIR USE IN THE PREPARATION OF UREAS, AND THE UREAS OBTAINED THEREBY BAYER AG (DE) 1985-09-18 EP claimed