SCHEMBL14014147

SCHEMBL14014147

Cc1ccc(NC(=O)C2(c3ccccc3)CCCC2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.77
NPSR1 Q6W5P4 3/20 0.69
HDAC1 Q13547 4/20 0.68
CYP2C9 P11712 2/20 0.68
CYP2C19 P33261 2/20 0.68
MEN1 O00255 1/20 0.68
CYP1A2 P05177 1/20 0.68
CYP3A4 P08684 1/20 0.68
CYP2D6 P10635 1/20 0.68
KMT2A Q03164 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
MAPT P10636 2/20 0.67
HTR1E P28566 1/20 0.67
S1PR3 Q99500 1/20 0.67
GAA P10253 1/20 0.67
KDM4E B2RXH2 1/20 0.62
HPGD P15428 1/20 0.62
HTT P42858 2/20 0.60
ALDH1A1 P00352 2/20 0.60
HDAC4 P56524 2/20 0.59

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
SCHEMBL22266637 0.88 LMNA (0.72) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL28593334 0.85 GAA (0.71) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL16383892 0.84 KDM4E (0.74) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL6628661 0.82 HDAC1 (0.71) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL19242711 0.82 NPSR1 (1.00) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL13842115 0.80 HDAC1 (0.68) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL28583860 0.79 KDM4E (0.63) LMNANPSR1HDAC1CYP2C9CYP2C19
SCHEMBL2861856 0.78 ERCC1 (0.68) LMNANPSR1CYP2C9CYP2C19MEN1
SCHEMBL24444629 0.78 LMNA (0.58) LMNAMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL16639040 0.77 HDAC4 (0.71) LMNANPSR1HDAC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF ADAMS JERRY LEROY 2008-11-20 US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 US disclosed
US-7427623-B2 4-Amino-2,3-disubstituted thieno[2,3-d]pyrimidines and pharmacetical compositions thereof SMITHKLINE BEECHAM CORPORATION (US) 2008-09-23 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 (1 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-20080287466-A1 4-AMINO-2,3-DISUBSTITUTED THIENO [2,3,D]PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF TIE1, TEK, KDR LMNA 4131/4885NPSR1 3862/4885HDAC1 4302/4885

“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.