SCHEMBL4837050

SCHEMBL4837050

CCOP(=O)(Cc1ccc(NC(=O)CCc2cnn(C)c2-c2ccc(Cl)cc2)cc1)OCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
HTR2A P28223 6/20 0.41
CHRM1 P11229 1/20 0.41
MCHR1 Q99705 1/20 0.41
HTR2C P28335 4/20 0.40
KDR P35968 3/20 0.39
YES1 P07947 2/20 0.39
JAK3 P52333 2/20 0.39
ENTPD1 P49961 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
LTA4H P09960 1/20 0.37
EPHX2 P34913 1/20 0.37
CACNA1G O43497 1/20 0.37
FLT1 P17948 1/20 0.36

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
SCHEMBL4836516 0.91 MCHR1 (0.40) MAPTMEN1LMNAKMT2AHTR2A
SCHEMBL4826251 0.91 HTR2A (0.42) MAPTMEN1LMNAGLAMAPK1
SCHEMBL4834035 0.88 ENPP2 (0.46) MAPTMEN1LMNAGLAMAPK1
SCHEMBL4834303 0.82 HDAC1 (0.42) MAPTMEN1LMNAMAPK1KMT2A
SCHEMBL4835225 0.82 MCHR1 (0.41) MAPTMEN1LMNAMAPK1KMT2A
SCHEMBL5777014 0.81 MEN1 (0.46) MAPTMEN1LMNAGLAMAPK1
SCHEMBL4834870 0.80 ALDH1A1 (0.43) MAPTMEN1LMNAMAPK1KMT2A
SCHEMBL4837046 0.79 HTR2A (0.39) MAPTMEN1LMNAGLAMAPK1
SCHEMBL5772629 0.79 MEN1 (0.46) MAPTMEN1LMNAGLAMAPK1
SCHEMBL4826262 0.79 HTR2A (0.40) MAPTMEN1LMNAGLAMAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287438-A1 Agent for preventing or treating neuropathy MOMOSE YU 2008-11-20 US disclosed
US-7423159-B2 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-09-09 US disclosed
US-20060004069-A1 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060004069-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 MAPT 3203/4885MEN1 3516/4885LMNA 2405/4885
US-20080287438-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 MAPT 3203/4885MEN1 3516/4885LMNA 2405/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.