SCHEMBL13041630

SCHEMBL13041630

CCCN1Cc2ccccc2N(C(C)C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ LMNA P02545 1/20 0.40
▸ PARP1 P09874 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ PARP2 Q9UGN5 1/20 0.40
▸ MAPK10 P53779 1/20 0.37
▸ XIAP P98170 1/20 0.36
▸ BIRC2 Q13490 1/20 0.36
▸ ADRA2A P08913 1/20 0.35
▸ ADRA2B P18089 1/20 0.35
▸ ADRA2C P18825 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ PRKCG P05129 2/20 0.34
▸ PRKCA P17252 2/20 0.34
▸ PRKCD Q05655 2/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ PRKCB P05771 1/20 0.34
▸ PRKCH P24723 1/20 0.34

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
SCHEMBL13041625 0.87 ALDH1A1 (0.39) ALDH1A1PARP1SMN1; SMN2PRKCGPRKCA
SCHEMBL13041643 0.85 ALOX15 (0.36) ALDH1A1KMT2AMEN1HTTSMN1; SMN2
SCHEMBL13041635 0.85 PARP1 (0.43) ALDH1A1KMT2APARP1HTTPARP2
SCHEMBL13041634 0.85 PARP1 (0.43) ALDH1A1KMT2AMEN1PARP1HTT
SCHEMBL13041639 0.84 PARP1 (0.43) ALDH1A1LMNAPARP1ADRA2ASMN1; SMN2
SCHEMBL13041640 0.81 PARP1 (0.44) PARP1PARP2CHRM2CHRM4CHRM5
SCHEMBL13041631 0.81 ENPP2 (0.51) KMT2APARP1SMN1; SMN2CYP2D6CYP2C9
SCHEMBL13041641 0.80 BRD4 (0.41) ALDH1A1LMNAPARP1SMN1; SMN2OPRM1
SCHEMBL13015326 0.80 BRD4 (0.42) ALDH1A1KMT2ALMNAPARP1SMN1; SMN2
SCHEMBL7885143 0.79 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1LMNAPARP1

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-20100278835-A1 NOVEL COMPOUNDS 660 ASTRAZENECA UK LIMITED (GB) 2010-11-04 — — US disclosed
US-20100278835-A1 NOVEL COMPOUNDS 660 ASTRAZENECA UK LIMITED (GB) 2010-11-04 — — 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 (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-20100278835-A1 NOVEL COMPOUNDS 660 RB1, RPP30, SARS1 ALDH1A1 2596/4885KMT2A 4545/4885MEN1 1527/4885

“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.

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