SCHEMBL5909347

SCHEMBL5909347

Cc1ccc(C(=O)N2CCCC2c2cccnc2)cn1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.59
▸ KDM4E B2RXH2 2/20 0.59
▸ PRMT5 O14744 1/20 0.53
▸ WDR77 Q9BQA1 1/20 0.53
▸ CHRNA7 P36544 2/20 0.52
▸ CHRNB2 P17787 2/20 0.52
▸ CHRNB4 P30926 2/20 0.52
▸ CHRNA3 P32297 2/20 0.52
▸ CHRNA4 P43681 2/20 0.52
▸ CHRNA2 Q15822 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ HTR3E A5X5Y0 1/20 0.52
▸ PSIP1 O75475 1/20 0.52
▸ TRPA1 O75762 1/20 0.52
▸ HTR3B O95264 1/20 0.52
▸ CHRNA1 P02708 1/20 0.52
▸ CHRNG P07510 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ CHRNB1 P11230 1/20 0.52

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
SCHEMBL5909354 0.89 CCNC (0.56) PRMT5WDR77LMNA
SCHEMBL17888397 0.88 ALDH1A1 (0.59) ALDH1A1KDM4EPRMT5WDR77CHRNA7
SCHEMBL17888296 0.85 KDM4E (0.63) ALDH1A1KDM4EPRMT5WDR77CHRNA7
SCHEMBL17886675 0.83 ALDH1A1 (0.56) ALDH1A1KDM4EPRMT5WDR77CHRNA7
SCHEMBL19226526 0.83 ALDH1A1 (0.56) ALDH1A1KDM4ECHRNA7CHRNB2CHRNB4
SCHEMBL21078063 0.81 ALDH1A1 (0.64) ALDH1A1KDM4EPRMT5WDR77CHRNA7
SCHEMBL30350219 0.80 ALDH1A1 (0.62) ALDH1A1KDM4EPRMT5WDR77CHRNA7
SCHEMBL19349767 0.80 CCNC (0.53) ALDH1A1KDM4EPRMT5WDR77LMNA
SCHEMBL19349706 0.80 CCNC (0.53) ALDH1A1KDM4EPRMT5WDR77LMNA
SCHEMBL19349705 0.80 CCNC (0.53) ALDH1A1KDM4EPRMT5WDR77LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030195195-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 — — US claimed
US-20060030557-A1 Substituted pyridines having antiangiogenic activity HAVIV FORTUNA 2006-02-09 — — US disclosed
US-20040014744-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2004-01-22 — — US disclosed
US-20030195195-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2003-10-16 — — 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-20040014744-A1 Substituted pyridines having antiangiogenic activity FLT1, FLT4, KDR ALDH1A1 206/4885KDM4E 848/4885PRMT5 1722/4885
US-20030195195-A1 Substituted pyridines having antiangiogenic activity FLT1, FLT4, KDR ALDH1A1 206/4885KDM4E 848/4885PRMT5 1722/4885
US-20060030557-A1 Substituted pyridines having antiangiogenic activity FLT4, KDR, FLT1 ALDH1A1 424/4885KDM4E 1039/4885PRMT5 1646/4885

“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.

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