SCHEMBL3593432

SCHEMBL3593432

[NH]c1cccc2c1NC(=O)N(CCO)C2

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.44
PARP2 Q9UGN5 2/20 0.44
TRPV1 Q8NER1 15/20 0.34
MYC P01106 1/20 0.33
ACHE P22303 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL3593434 0.82 PARP1 (0.47) PARP1PARP2TRPV1MYCACHE
SCHEMBL3596146 0.82 PARP1 (0.46) PARP1PARP2KDM4EALOX15HTT
SCHEMBL3594621 0.78 ACE (0.46) PARP1PARP2TRPV1ACHE
SCHEMBL3587265 0.76 BRD4 (0.54) PARP1
SCHEMBL3600319 0.71 TRPV1 (0.45) TRPV1
SCHEMBL3588936 0.71 BRD4 (0.40) PARP1PARP2TRPV1ACHE
SCHEMBL2194813 0.66 CRBN (0.44) PARP1PARP2TRPV1KDM4ELMNA
SCHEMBL3606126 0.66 CREBBP (0.32)
SCHEMBL3600321 0.66 CA9 (0.47) TRPV1KDM4E
SCHEMBL8952617 0.65 HDAC6 (0.34) PARP1PARP2KDM4EALOX15HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2010-01-21 US disclosed
EP-2128157-A1 HETEROCYCLIDENE-N-(ARYL)ACETAMIDE DERIVATIVE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2009-12-02 EP 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 (1 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-20100016285-A1 HETEROCYCLIDENE-N-(ARYL) ACETAMIDE DERIVATIVE CCNY, CCND3, NSD3 PARP1 1468/4885PARP2 2079/4885TRPV1 2518/4885

“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.