SCHEMBL4146085

SCHEMBL4146085

CNc1nccc2cc(C(=O)C(C)(C)C)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIPK2 Q9H2X6 4/20 0.45
CSNK2A1 P68400 2/20 0.45
ACACB O00763 2/20 0.43
ACACA Q13085 2/20 0.43
NR1H4 Q96RI1 3/20 0.36
PLK1 P53350 1/20 0.35
JAK2 O60674 1/20 0.34
TYK2 P29597 1/20 0.34
SCN9A Q15858 2/20 0.34
IGFBP3 P17936 1/20 0.34
APAF1 O14727 1/20 0.34
NSD2 O96028 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CNR2 P34972 1/20 0.34
HCAR3 P49019 1/20 0.33
SCN5A Q14524 1/20 0.33

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
SCHEMBL4146071 0.89 ACACB (0.43) HIPK2CSNK2A1ACACBACACACNR2
SCHEMBL4407780 0.84 ALDH1A1 (0.49) HIPK2CSNK2A1ACACBACACAPLK1
SCHEMBL30204784 0.84 CSNK2A1 (0.48) HIPK2CSNK2A1ACACBACACAHCAR3
SCHEMBL2671657 0.84 CSNK2A1 (0.48) HIPK2CSNK2A1ACACBACACAHCAR3
SCHEMBL4137619 0.77 HIPK2 (0.45) HIPK2CSNK2A1ACACBACACANR1H4
SCHEMBL2671662 0.77 CA12 (0.46) HIPK2CSNK2A1L3MBTL1HSD17B10
SCHEMBL13084187 0.74 NR1I2 (0.37) HIPK2CSNK2A1ACACBACACAHSD17B10
SCHEMBL25270379 0.73 CSNK2A1 (0.53) HIPK2CSNK2A1HCAR3
SCHEMBL12663945 0.72 PROKR1 (0.42) TYK2HCAR3
SCHEMBL2671305 0.72 PLAU (0.55) HIPK2CSNK2A1ACACBACACAHCAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9181252-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-11-10 US disclosed
US-9181252-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-11-10 US disclosed
US-20150152109-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-06-04 US disclosed
US-20150152109-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-06-04 US disclosed
US-8993586-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-03-31 US disclosed
US-8993586-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2015-03-31 US disclosed
US-20150025098-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-01-22 US disclosed
US-20150025098-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC. (US) 2015-01-22 US disclosed
US-8859773-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2014-10-14 US disclosed
US-8859773-B2 N1/N2-lactam acetyl-CoA carboxylase inhibitors PFIZER INC. (US) 2014-10-14 US disclosed
US-20120108619-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS PFIZER INC 2012-05-03 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 (3 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-20150025098-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS ACACA, ACACB, COASY HIPK2 4621/4885CSNK2A1 584/4885ACACB 2/4885
US-20150152109-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS ACACA, ACACB, COASY HIPK2 4621/4885CSNK2A1 584/4885ACACB 2/4885
US-20120108619-A1 N1/N2-LACTAM ACETYL-COA CARBOXYLASE INHIBITORS ACACA, ACACB, COASY HIPK2 4621/4885CSNK2A1 584/4885ACACB 2/4885

“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.