SCHEMBL14922889

SCHEMBL14922889

C/C=C\C=C1/C(=N)Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 6/20 0.35
MAOA P21397 2/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
KDM4E B2RXH2 2/20 0.33
BCHE P06276 1/20 0.32
CES1 P23141 1/20 0.32
SLC6A2 P23975 4/20 0.32
CYP1A2 P05177 4/20 0.32
CYP3A4 P08684 4/20 0.32
RET P07949 3/20 0.32
LMNA P02545 3/20 0.32
CYP2C19 P33261 3/20 0.32
ADRB2 P07550 2/20 0.32
CHRM2 P08172 2/20 0.32
CHRM4 P08173 2/20 0.32
ADRB1 P08588 2/20 0.32
HTR1A P08908 2/20 0.32
CHRM5 P08912 2/20 0.32
ADRA2A P08913 2/20 0.32

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
SCHEMBL19682258 0.82 MAOA (0.39) CHRM1MAOAKMT2AMEN1KDM4E
SCHEMBL20272361 0.81 CHRM1 (0.37) CHRM1MAOAKMT2AMEN1KDM4E
SCHEMBL21784415 0.79 MEN1 (0.39) CHRM1MAOAKMT2AMEN1KDM4E
SCHEMBL16281504 0.76 ACHE (0.40) MAOAKMT2AMEN1KDM4EBCHE
SCHEMBL20198315 0.71 MAOA (0.46) MAOAKDM4EBCHECES1CYP1A2
SCHEMBL27726559 0.70
SCHEMBL27855844 0.69 MAOA (0.56) CHRM1MAOAKMT2AMEN1KDM4E
SCHEMBL11785699 0.66 MAPT (0.50) MAOAKMT2AMEN1KDM4EBCHE
SCHEMBL11785702 0.66 MAPT (0.50) MAOAKMT2AMEN1KDM4EBCHE
SCHEMBL17472428 0.66 MAOA (0.38) CHRM1MAOAKMT2AMEN1KDM4E

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-20160324973-A1 COMPOSITION COMPRISING A POLYMERIC REAGENT NEKTAR THERAPEUTICS 2016-11-10 US disclosed
US-9381254-B2 Methods for preparing polymeric reagents NEKTAR THERAPEUTICS (US) 2016-07-05 US disclosed
US-20160022830-A1 METHODS FOR PREPARING POLYMERIC REAGENTS NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-20150141665-A1 METHODS FOR PREPARING POLYMERIC REAGENTS NEKTAR THERAPEUTICS (US) 2015-05-21 US disclosed
US-8703115-B2 Methods for preparing conjugates NEKTAR THERAPEUTICS (US) 2014-04-22 US disclosed
US-8435505-B2 Pharmaceutical compositions and methods for delivering such compositions NEKTAR THERAPEUTICS (US) 2013-05-07 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-20160324973-A1 COMPOSITION COMPRISING A POLYMERIC REAGENT CAT, LPO, GPX4 CHRM1 4515/4885MAOA 221/4885KMT2A 2707/4885
US-20150141665-A1 METHODS FOR PREPARING POLYMERIC REAGENTS PAM, ALKBH3, DNPEP CHRM1 2540/4885MAOA 1085/4885KMT2A 1128/4885
US-20160022830-A1 METHODS FOR PREPARING POLYMERIC REAGENTS PAM, ALKBH3, DNPEP CHRM1 2540/4885MAOA 1085/4885KMT2A 1128/4885

“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.