SCHEMBL6065656

SCHEMBL6065656

CCc1ccccc1C[NH2+]Cc1ccccc1CC.Fc1cc(F)c(F)c([B-](c2cc(F)cc(F)c2F)(c2cc(F)cc(F)c2F)c2cc(F)cc(F)c2F)c1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.35
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6065757 0.87 PKM (0.35) PKMMAPTSMN1; SMN2
SCHEMBL6065840 0.86 TAAR1 (0.34)
SCHEMBL6065022 0.82 PKM (0.33) PKMMAPTSMN1; SMN2
SCHEMBL6065526 0.79 PKM (0.31) PKMMAPTSMN1; SMN2
SCHEMBL6065861 0.77 PKM (0.30) PKMMAPTSMN1; SMN2
SCHEMBL6065850 0.77 TSHR (0.33) PKMMAPTSMN1; SMN2
SCHEMBL5703339 0.77 GABRA1 (0.32)
SCHEMBL6066164 0.76 MAPT (0.33) PKMMAPTSMN1; SMN2
SCHEMBL6065872 0.74 SHBG (0.31) PKMMAPTSMN1; SMN2
SCHEMBL6065557 0.74 TSHR (0.31) PKMMAPTSMN1; SMN2

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-7101940-B2 Chemical compound, method for the production thereof and its use in catalyst systems for producing polyolefins BASELL POLYOLEFINE GMBH (DE) 2006-09-05 US disclosed
US-20030013913-A1 Chemical compound, method for the production thereof and its use in catalyst systems for producing polyolefins EQUISTAR CHEMICALS, LP 2003-01-16 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-20030013913-A1 Chemical compound, method for the production thereof and its use in catalyst systems for producing polyolefins SCO2, CNOT1, CYC1 PKM 621/4885MAPT 3929/4885SMN1; SMN2 3830/4885

“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.