SCHEMBL7566869

SCHEMBL7566869

COc1ccc(-c2ccc3cccc(C4CCCCN4C)c3c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.46
ERBB2 P04626 2/20 0.46
ERBB3 P21860 2/20 0.46
KDR P35968 2/20 0.46
PTK2 Q05397 2/20 0.46
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
HTR6 P50406 1/20 0.39
CHRNB1 P11230 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNB3 Q05901 1/20 0.39

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
SCHEMBL7568479 0.93 MMP2 (0.43) EGFRERBB2ERBB3KDRPTK2
SCHEMBL9325734 0.90 MTNR1A (0.50) MTNR1AMTNR1BCHRNB4CHRNA3
SCHEMBL6313386 0.80 MTNR1A (0.46) EGFRERBB2ERBB3KDRPTK2
SCHEMBL7572411 0.78 CHRNB2 (0.40) CHRNB2CHRNB4CHRNA3
SCHEMBL7812867 0.77 CHRNB2 (0.52) EGFRERBB2CHRNB2CHRNB4CHRNA3
SCHEMBL6308711 0.74 USP2 (0.47) MTNR1A
SCHEMBL7571886 0.74 CHRNB2 (0.44) CHRNB2CHRNB4CHRNA3
SCHEMBL21590257 0.73 CHRNB4 (0.45) CHRNB4CHRNA3
SCHEMBL6314991 0.72 HTR1A (0.64) MTNR1B
SCHEMBL12090214 0.71 CHRNA7 (0.56) CHRNB2CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020058811-A1 Naphthalene derivatives CHENARD BERTRAND L (US) 2002-05-16 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 (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-20020058811-A1 Naphthalene derivatives HTR4, CNR1, CNR2 EGFR 1635/4885ERBB2 2282/4885ERBB3 2330/4885

“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.