SCHEMBL2589911

SCHEMBL2589911

Clc1cc(-c2cc3ncccc3c(N3CCOCC3)n2)ccc1NCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.47
MOK Q9UQ07 1/20 0.45
ACP1 P24666 1/20 0.45
METAP1 P53582 2/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
PDE5A O76074 1/20 0.44
MTOR P42345 3/20 0.43
PIK3CA P42336 3/20 0.43
ACHE P22303 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 3/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PIK3CD O00329 1/20 0.41
KDR P35968 1/20 0.41
KCNH2 Q12809 1/20 0.41
LMNA P02545 1/20 0.41
PIK3CB P42338 2/20 0.40

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
SCHEMBL2588987 0.82 METAP1 (0.47) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL2588951 0.82 MAPK1 (0.45) SYKMETAP1ALOX15MAPK1PDE5A
SCHEMBL2590914 0.82 PKM (0.48) SYKACP1MAPK1KDR
SCHEMBL14902608 0.81 MAPK1 (0.47) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL2584987 0.80 SYK (0.48) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL2577487 0.77 MAPK1 (0.48) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL2588826 0.76 PIK3CD (0.57) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL14900561 0.74 SYK (0.53) SYKMETAP1ALOX15MAPK1MTOR
SCHEMBL2590977 0.73 ALOX15 (0.45) METAP1ALOX15MAPK1MTORPIK3CA
SCHEMBL2586562 0.73 ALOX15 (0.45) SYKMETAP1ALOX15MAPK1MTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9266879-B2 Naphthridine derivatives as PI3K inhibitors for the treatment of cancer and immune-inflammatory disease KARUS THERAPEUTIC LIMITED (GB) 2016-02-23 US disclosed
EP-2563788-B1 NAPHTHRIDINE DERIVATIVES AS PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNE-INFLAMMATORY DISEASES KARUS THERAPEUTICS LTD (GB) 2015-08-05 EP disclosed
US-20130109688-A1 Naphthridine derivatives as PI3K inhibitors for the treatment of cancer and immune-inflammatory disease KARUS THERAPEUTICS LIMITED (UK) 2013-05-02 US disclosed
EP-2563788-A1 NAPHTHRIDINE DERIVATIVES AS PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNE - INFLAMMATORY DISEASES Karus Therapeutics Limited (GB) 2013-03-06 EP disclosed
WO-2011135351-A1 NAPHTHRIDINE DERIVATIVES AS PI3K INHIBITORS FOR THE TREATMENT OF CANCER AND IMMUNE - INFLAMMATORY DISEASES KARUS THERAPEUTICS LIMITED (GB) 2011-11-03 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-20130109688-A1 Naphthridine derivatives as PI3K inhibitors for the treatment of cancer and immune-inflammatory disease PIK3R5, PIK3CA, NFKBIA SYK 140/4885MOK 354/4885ACP1 2287/4885

“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.