SCHEMBL2248234

SCHEMBL2248234

O=C1C[N]CCN1c1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ MAPT P10636 3/20 0.44
▸ ALOX5 P09917 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ P2RX7 Q99572 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ MEN1 O00255 3/20 0.43
▸ CTSG P08311 1/20 0.43
▸ CMA1 P23946 1/20 0.43
▸ HTR3E A5X5Y0 1/20 0.42
▸ HTR3B O95264 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ ADRB1 P08588 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HTR1A P08908 1/20 0.42

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
SCHEMBL1161143 0.81 MEN1 (0.50) ALDH1A1KMT2AMAPTALOX5GAA
SCHEMBL2253286 0.77 BPTF (0.44) HTR1ADRD2
SCHEMBL6028118 0.75 ALDH1A1 (0.64) ALDH1A1KMT2AALOX5GAAKDM4E
SCHEMBL6068510 0.74 CYP11B2 (0.47) ALDH1A1MAPTGAAHTTDRD2
SCHEMBL218554 0.74 HTR3E (0.62) ALDH1A1MAPTLMNAALOX12SMN1; SMN2
SCHEMBL4241682 0.73 CHKA (0.39) ALDH1A1KMT2ALMNAMEN1CYP3A4
SCHEMBL2256178 0.72 P2RX7 (0.42) ALDH1A1MAPTALOX5P2RX7ADRB1
SCHEMBL1751576 0.72 ALOX5 (0.47) ALDH1A1KMT2AMAPTALOX5GAA
SCHEMBL21424922 0.71 DRD2 (0.57) ALDH1A1KMT2AMAPTGAAP2RX7
SCHEMBL3657785 0.71 SLC6A4 (0.58) ALDH1A1KMT2AMAPTALOX5P2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8354413-B2 Quinolin-4-one and 4-oxodihydrocinnoline derivatives as inhibitors of poly(ADP-ribose) polymerase (PARP) Istituto di Ricerche di Biologia Molecolare P. Angeletti, S.R.L. (IT) 2013-01-15 — — US disclosed
US-20110207720-A1 QUINOLIN-4-ONE AND 4-OXODIHYRDOCINNOLINE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.R.L. (IT) 2011-08-25 — — US disclosed
EP-2193121-A1 QUINOLIN-4-ONE AND 4-OXODIHYDROCINNOLINE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) Istituto Di Ricerche Di Biologia Molecolare P. Angeletti S.P.A. (IT) 2010-06-09 — — EP disclosed
WO-2009027730-A1 QUINOLIN-4-ONE AND 4-OXODIHYDROCINNOLINE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2009-03-05 — — WO 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-20110207720-A1 QUINOLIN-4-ONE AND 4-OXODIHYRDOCINNOLINE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE) POLYMERASE (PARP) PARP1, PARP2, PARP11 ALDH1A1 248/4885KMT2A 3283/4885MAPT 359/4885

“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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