SCHEMBL4799432

SCHEMBL4799432

C(#CC1CCNCC1)c1ccc2c(c1)[CH]N=CN2

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH2 P05091 1/20 0.35
P2RY6 Q15077 1/20 0.30

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
SCHEMBL4797623 0.92 CSF1R (0.31) ALDH2
SCHEMBL4797241 0.85 DRD2 (0.33)
SCHEMBL21722912 0.66 HTR3A (0.42) ALDH2
SCHEMBL1200030 0.65 SIGMAR1 (0.45)
SCHEMBL21722951 0.64 SLC6A4 (0.42)
Hydrochloric Acid SCHEMBL1532735 0.64 SIGMAR1 (0.44)
Hydrochloric Acid SCHEMBL31556514 0.61 HTR2C (0.54)
SCHEMBL28144221 0.61 CYP2A6 (0.44)
Hydrochloric Acid SCHEMBL31556501 0.60 HTR2C (0.55)
SCHEMBL22197977 0.58 PTPN11 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7332493-B2 Substituted bicyclic derivatives for the treatment of abnormal cell growth OSI PHARMACEUTICALS (US) 2008-02-19 US disclosed
US-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth PFIZER INC 2005-07-21 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-20050159435-A1 Substituted bicyclic derivatives for the treatment of abnormal cell growth CCNA1, CCNT1, CCNB1 ALDH2 1689/4885P2RY6 3174/4885

“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.