SCHEMBL15522686

SCHEMBL15522686

CC1(C)CCN2CCNC(=O)c3cccc1c32

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
TNNI3 P19429 1/20 0.42
TNNT2 P45379 1/20 0.42
TNNC1 P63316 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
PARP1 P09874 17/20 0.40
PARP10 Q53GL7 1/20 0.37
PARP11 Q9NR21 1/20 0.37
CCNC P24863 1/20 0.34
CDK8 P49336 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
SCHEMBL15522951 0.83 PARP1 (0.36) PARP1PARP10PARP11
SCHEMBL7644556 0.77 MEN1 (0.53) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL14096271 0.72 MEN1 (0.42) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL1533025 0.72 PARP10 (0.46) PARP1PARP10PARP11
SCHEMBL6202369 0.72 HTR2C (0.53) HTR2CHTR2BPARP1PARP10PARP11
SCHEMBL15522811 0.71 HTR2C (0.76) HTR2AHTR2CHTR2B
SCHEMBL7649483 0.70 MEN1 (0.71) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL15578653 0.69 MEN1 (0.41) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL22393385 0.67 HTR2A (0.39) MEN1TNNI3TNNT2TNNC1KMT2A
SCHEMBL2060502 0.65 PARP1 (0.51) PARP1PARP10PARP11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200283439-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES AbbVie Deutschland GmbH & Co. KG (DE) 2020-09-10 US claimed
US-20190071443-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES AbbVie Deutschland GmbH & Co. KG (DE) 2019-03-07 US claimed
US-20160016954-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-21 US claimed
US-20140080816-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-20 US claimed
US-20140080814-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-20 US claimed
US-20140080813-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES ABBVIE DEUTSCHLAND (DE) 2014-03-20 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20140080813-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885
US-20160016954-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885
US-20140080816-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885
US-20200283439-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885
US-20140080814-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885
US-20190071443-A1 TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES HTR2C, HTR2A, HTR5A MEN1 2568/4885TNNI3 1258/4885TNNT2 1195/4885

“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.