SCHEMBL3540302

SCHEMBL3540302

NCCCCCCC(N)c1nc(/C=C/c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)nc2cc(Cl)ccc12

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.38
AKR1C3 P42330 2/20 0.38
LMNA P02545 2/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.34
UBE2N P61088 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
PTGER1 P34995 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
SCHEMBL3540304 1.00 KCNA3 (0.38) KCNA3AKR1C3LMNAKDM4EPOLB
SCHEMBL3533587 0.83 TUBB4A (0.39)
SCHEMBL3533588 0.83 TUBB4A (0.39)
SCHEMBL3534230 0.83 KCNA3 (0.41) KCNA3AKR1C3LMNAKDM4EPOLB
SCHEMBL3534232 0.83 KCNA3 (0.41) KCNA3AKR1C3LMNAKDM4EPOLB
SCHEMBL3540944 0.81 TUBB4A (0.36)
SCHEMBL3540947 0.81 TUBB4A (0.36)
SCHEMBL3537200 0.81 KCNA3 (0.39) KCNA3AKR1C3LMNAKDM4EPOLB
SCHEMBL3537592 0.80 LTA4H (0.42)
SCHEMBL3537590 0.80 LTA4H (0.42)

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-7829566-B2 Such as (7-chloro-2-styryl-quinazolin-4-yl)-(3-imidazol-1-yl-propyl)-amine; glycoprotein antagonist; anticholesterol agents; cardiovascular disorders; strokes; antiischemic agents MEDERSKI WERNER 2010-11-09 US disclosed
US-20070293667-A1 4-Amino-quinazolines MEDERSKI WERNER 2007-12-20 US disclosed
US-20040044204-A1 4-amino-quinazolines ORTHO-MCNEIL PHARMACEUTICALS, INC. 2004-03-04 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-20040044204-A1 4-amino-quinazolines MRGPRX4, MRGPRX1, MRGPRX2 KCNA3 457/4885AKR1C3 3764/4885LMNA 2412/4885
US-20070293667-A1 4-Amino-quinazolines MRGPRX4, MRGPRX1, MRGPRX2 KCNA3 579/4885AKR1C3 3582/4885LMNA 2615/4885

“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.