SCHEMBL17356392

SCHEMBL17356392

CC(=O)c1cccc(Oc2n[nH]c(=O)c3ccccc23)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 11/20 0.52
▸ PARP2 Q9UGN5 1/20 0.52
▸ PARP3 Q9Y6F1 1/20 0.52
▸ ALK Q9UM73 1/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ALPL P05186 1/20 0.46
▸ ALPI P09923 1/20 0.46
▸ ALPG P10696 1/20 0.46
▸ F10 P00742 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ MAPK1 P28482 1/20 0.42
▸ POLB P06746 1/20 0.41

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
SCHEMBL15002455 0.88 AKR1C3 (0.55) PARP1PARP2PARP3F10MAPK1
SCHEMBL16488685 0.87 PARP1 (0.52) PARP1PARP2PARP3F10
SCHEMBL15002580 0.84 KDM4E (0.58) PARP1PARP2PARP3MEN1KMT2A
SCHEMBL15002410 0.83 PARP1 (0.66) PARP1PARP2PARP3
SCHEMBL15002430 0.81 PARP1 (0.69) PARP1PARP2PARP3MEN1KMT2A
SCHEMBL19998330 0.81 PARP1 (0.66) PARP1PARP2PARP3
SCHEMBL17356391 0.79 MAOB (0.49) PARP1ALPLALPIALPGALDH1A1
SCHEMBL15002563 0.79 PARP1 (0.69) PARP1PARP2PARP3MEN1KMT2A
SCHEMBL15002406 0.79 PARP1 (0.72) PARP1PARP2PARP3
SCHEMBL15002561 0.77 PARP1 (0.64) PARP1PARP2PARP3

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-9718787-B2 Poly (ADP-ribose) polymerase inhibitor CHENGDU DI'AO PHARMACEUTICAL GROUP CO., LTD. (CN) 2017-08-01 — — US disclosed
US-20150368205-A1 POLY (ADP-RIBOSE) POLYMERASE INHIBITOR CHENGDU DI'AO PHARMACEUTICAL GROUP CO., LTD. (CN) 2015-12-24 — — 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-20150368205-A1 POLY (ADP-RIBOSE) POLYMERASE INHIBITOR PARP1, PARP2, PARP11 PARP1 1/4885PARP2 2/4885PARP3 10/4885

“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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