SCHEMBL11616

SCHEMBL11616

CN(C(=O)C1CC1)C1CCNC1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 17/20 0.46
SLC6A2 P23975 16/20 0.43
KCNH2 Q12809 2/20 0.43
SLC6A3 Q01959 5/20 0.38
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL17961728 1.00 SLC6A4 (0.46) SLC6A4SLC6A2KCNH2SLC6A3CYP3A4
SCHEMBL17961761 1.00 SLC6A4 (0.46) SLC6A4SLC6A2KCNH2SLC6A3CYP3A4
Hydrochloric Acid SCHEMBL21772854 0.98 SLC6A4 (0.44) SLC6A4SLC6A2KCNH2SLC6A3CYP3A4
SCHEMBL21772847 0.93 SLC6A4 (0.44) SLC6A4SLC6A2KCNH2SLC6A3CYP2D6
Hydrochloric Acid SCHEMBL28595890 0.91 SLC6A4 (0.43) SLC6A4SLC6A2KCNH2SLC6A3CYP2D6
SCHEMBL15421980 0.89 SLC6A1 (0.44) SLC6A4SLC6A2KCNH2SLC6A3CYP2D6
SCHEMBL12141653 0.88 GABRP (0.41) SLC6A4SLC6A2KCNH2SLC6A3CYP2D6
SCHEMBL30419392 0.86 SLC6A4 (0.42) SLC6A4SLC6A2KCNH2SLC6A3CYP3A4
SCHEMBL17961750 0.86 CHRNB2 (0.38) SLC6A4SLC6A2KCNH2
SCHEMBL25565972 0.84 GABRP (0.46) SLC6A4SLC6A2KCNH2SLC6A3CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3030557-B1 A NOVEL PHTALAZINONE DERIVATIVES AND MANUFACTURING PROCESS THEREOF IDIENCE CO LTD (KR) 2023-05-31 EP disclosed
US-RE49338-E1 Phthalazinone derivatives and manufacturing process thereof IDIENCE CO., LTD. (KR) 2022-12-20 US disclosed
US-9844550-B2 Phtalazinone derivatives and manufacturing process thereof ILDONG PHARM CO., LTD (KR) 2017-12-19 US disclosed
US-20170182045-A1 Novel Phtalazinone Derivatives and Manufacturing Process Thereof IL DONG HOLDINGS CO., LTD (KR) 2017-06-29 US disclosed
US-9682973-B2 Phtalazinone derivatives and manufacturing process thereof ILDONG PHARM CO., LTD (KR) 2017-06-20 US disclosed
US-20160222003-A1 Novel Phtalazinone Derivatives and Manufacturing Process Thereof IL DONG HOLDINGS CO., LTD (KR) 2016-08-04 US disclosed
WO-2011066211-A1 AZABENZIMIDAZOLES AS FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2011-06-03 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 (2 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-20160222003-A1 Novel Phtalazinone Derivatives and Manufacturing Process Thereof PARP15, PARP10, PARP1 SLC6A4 4250/4885SLC6A2 4664/4885KCNH2 4100/4885
US-20170182045-A1 Novel Phtalazinone Derivatives and Manufacturing Process Thereof PARP15, PARP10, NUDT5 SLC6A4 3692/4885SLC6A2 4431/4885KCNH2 2825/4885

“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.