SCHEMBL16234584

SCHEMBL16234584

C/N=C/C=N\c1ccccc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.53
LMNA P02545 6/20 0.53
HPGD P15428 2/20 0.53
MAPT P10636 6/20 0.44
ALDH1A1 P00352 6/20 0.44
KDM4E B2RXH2 3/20 0.44
RECQL P46063 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
POLB P06746 1/20 0.44
MPI P34949 1/20 0.44
HTT P42858 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
PKM P14618 1/20 0.41
TSHR P16473 4/20 0.39

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
SCHEMBL239325 0.93 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL29472028 0.93 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL239326 0.93 CYP2C9 (0.59) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL17591502 0.83 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL14404845 0.83 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL7091919 0.80 CYP2C9 (0.52) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL21728463 0.80 CYP2C9 (0.52) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL12332461 0.80 CYP2C9 (0.52) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL19625972 0.78 LMNA (0.50) CYP2C9LMNAHPGDMAPTALDH1A1
SCHEMBL12459466 0.76 CYP2C9 (0.57) CYP2C9LMNAHPGDMAPTALDH1A1

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
US-9505878-B2 Catalysts and methods for polymer synthesis NOVOMER, INC. (US) 2016-11-29 US disclosed
US-9403861-B2 Salen complexes with dianionic counterions NOVOMER, INC. (US) 2016-08-02 US disclosed
US-20150252145-A1 CATALYSTS AND METHODS FOR POLYMER SYNTHESIS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2015-09-10 US disclosed
US-8956989-B2 Catalysts and methods for polymer synthesis NOVOMER, INC. (US) 2015-02-17 US disclosed
US-8951930-B2 Catalysts and methods for polymer synthesis NOVOMER, INC. (US) 2015-02-10 US disclosed
US-8946109-B2 Catalysts and methods for polymer synthesis NOVOMER, INC. (US) 2015-02-03 US disclosed
US-20140336354-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2014-11-13 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 (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-20140336354-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NCLN, POLN, NCL CYP2C9 4344/4885LMNA 938/4885HPGD 3013/4885
US-20150252145-A1 CATALYSTS AND METHODS FOR POLYMER SYNTHESIS PPOX, COASY, SOD1 CYP2C9 565/4885LMNA 3764/4885HPGD 143/4885

“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.