SCHEMBL29331199

SCHEMBL29331199

Brc1cccc([C@@H]2CCCCN2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ CYP2D6 P10635 2/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ CHRNB2 P17787 2/20 0.54
▸ CHRNA7 P36544 2/20 0.54
▸ CHRNA4 P43681 2/20 0.54
▸ POLB P06746 2/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ CYP1A2 P05177 1/20 0.54
▸ CYP2A6 P11509 1/20 0.54
▸ CYP2C9 P11712 1/20 0.54
▸ KDM1A O60341 3/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ EPAS1 Q99814 2/20 0.39
▸ DRD2 P14416 1/20 0.38
▸ DRD1 P21728 1/20 0.38
▸ DRD4 P21917 1/20 0.38
▸ DRD5 P21918 1/20 0.38
▸ DRD3 P35462 1/20 0.38

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
SCHEMBL15447576 1.00 MEN1 (0.54) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL30551214 1.00 MEN1 (0.54) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL29086568 0.95 CHRNB2 (0.53) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL29964556 0.95 CHRNB2 (0.53) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL29884098 0.95 CHRNB2 (0.53) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL2527089 0.95 CHRNB2 (0.53) MEN1KMT2ACYP2D6CYP2C19CHRNB2
Hydrochloric Acid SCHEMBL22498444 0.93 CHRNB2 (0.51) MEN1KMT2ACYP2D6CYP2C19CHRNB2
Hydrochloric Acid SCHEMBL3725483 0.93 CHRNB2 (0.51) MEN1KMT2ACYP2D6CYP2C19CHRNB2
SCHEMBL28848937 0.85 KDM1A (0.48) MEN1KMT2ACHRNB2CHRNA4POLB
SCHEMBL468999 0.79 MEN1 (0.54) MEN1KMT2ACYP2D6CYP2C19CHRNB2

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-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 — — 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-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 MEN1 142/4885KMT2A 4008/4885CYP2D6 33/4885

“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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